CN(C)c1nc(C)c(C)nc1C	ZINC000000002211	c1cnccn1
Clc3ccc(C(=O)N2CCC(c1cnc[nH]1)CC2)c(Cl)c3	ZINC000000006000	O=C(N2CCC(c1cnc[nH]1)CC2)c3ccccc3
Oc1ccc(NC(=O)C(Cl)(Cl)Cl)cc1	ZINC000000002214	c1ccccc1
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)CCN4Cc3ccccc3C4=O	ZINC000012466190	O=C(CCN2Cc1ccccc1C2=O)NCC4CCN(C3CCNCC3)CC4
CN3CCN(C(=O)c2ccc(c1ccc(Br)cc1)o2)CC3	ZINC000000101734	O=C(N1CCNCC1)c3ccc(c2ccccc2)o3
COc3ccc(c2nc1cc(C)ccc1o2)cc3NC(=O)c4ccco4	ZINC000000191020	O=C(Nc3cccc(c2nc1ccccc1o2)c3)c4ccco4
COc4ccc3[nH]c(C(=O)N2CCC(Cc1ccccc1)CC2)cc3c4	ZINC000000118993	O=C(N2CCC(Cc1ccccc1)CC2)c4cc3ccccc3[nH]4
CC(C)C(=O)N2N=C(c1ccc(N(=O)=O)cc1)C[C@@]2(O)C(F)(F)F	ZINC000000108432	C2CC(c1ccccc1)=NN2
CN(C)CCn1c(=O)c2ccc3c(=O)n(CCN(C)C)c(=O)c4ccc(c1=O)c2c34	ZINC000003975314	O=c1[nH]c(=O)c2ccc4c(=O)[nH]c(=O)c3ccc1c2c34
NC(=O)c2ccc(NC(=O)c1ccc(Br)o1)cc2	ZINC000000038378	O=C(Nc1ccccc1)c2ccco2
OC[C@@H]2O[C@H](n1cc(C(F)(F)F)c(=O)[nH]c1=O)C[C@H]2O	ZINC000000002219	O=c2ccn(C1CCCO1)c(=O)[nH]2
C4CCN(CCCNC2C1CC3CC(C1)CC2C3)C4	ZINC000001821711	C4CCN(CCCNC2C1CC3CC(C1)CC2C3)C4
CCn2cc(S(=O)(=O)CC(=O)NC1CCCCC1)c3ccccc23	ZINC000000201446	O=C(CS(=O)(=O)c1c[nH]c2ccccc12)NC3CCCCC3
COc1ccc(C(C)=O)c(O)c1	ZINC000000001906	c1ccccc1
Cc3ccc(c2c/c(=C/c1ccc(C)c(N(=O)=O)c1)c(=O)o2)c(C)c3	ZINC000000066720	O=c2oc(c1ccccc1)cc2=Cc3ccccc3
CCNC(=O)[C@@H]4C[C@@H](n3cc(c2ccc(CN1CCCC1)cc2)nn3)CN4	ZINC000067804560	C4CCN(Cc3ccc(c2cn(C1CCNC1)nn2)cc3)C4
Cc1noc(C)c1C(=O)N3CCC(C(=O)c2ccc(F)cc2F)CC3	ZINC000000111700	O=C(C2CCN(C(=O)c1cnoc1)CC2)c3ccccc3
O=C(C[C@@H]1CCNC[C@@H]1Cc3cc(CN2CCCCC2)on3)NCc5ccc4OCOc4c5	ZINC000012482508	O=C(CC1CCNCC1Cc3cc(CN2CCCCC2)on3)NCc5ccc4OCOc4c5
CC(C)(C)NC(=O)N3CCN(c2nc(c1ccccc1)ns2)CC3	ZINC000000117408	C3CN(c2nc(c1ccccc1)ns2)CCN3
Cc2ccc(S(=O)(=O)N/N=C/c1ccccc1O)cc2	ZINC000000032137	O=S(=O)(NN=Cc1ccccc1)c2ccccc2
COc1cc(SC)ccc1C(=O)Nc2cccc(C(F)(F)F)c2	ZINC000000067921	O=C(Nc1ccccc1)c2ccccc2
COc1cc(CNC(C)C)ccc1OC[C@@H](O)CN2CCSCC2	ZINC000012593346	C(COc1ccccc1)CN2CCSCC2
Cn3c(=O)cc4c1ccccc1c(=O)c5c(N2CCOCC2)ccc3c45	ZINC000000033449	O=c3cc4c1ccccc1c(=O)c5c(N2CCOCC2)ccc([nH]3)c45
C[N@]3CCC[C@@H](NC(=O)NCCCN2CCN(c1ncccn1)CC2)C3	ZINC000052522560	O=C(NCCCN2CCN(c1ncccn1)CC2)NC3CCCNC3
CN4CCN(c1ncccc1NC(=O)CCc3cc2CNCCCn2n3)CC4	ZINC000072473252	O=C(CCc2cc1CNCCCn1n2)Nc3cccnc3N4CCNCC4
CC(C)CN3CCC([C@@H]2CC[N@@](Cc1cnc(C)n1C)C2)CC3	ZINC000011664250	C3CC(C2CCN(Cc1cnc[nH]1)C2)CCN3
C[C@H]2C[N@]1C[C@H](O)C[C@H]1CN2Cc4ccc(n3ccnc3C)cc4	ZINC000019288265	C4CC3CN(Cc2ccc(n1ccnc1)cc2)CCN3C4
O=Cc4ccc(Sc2nnc(c1ccccc1)n2c3ccccc3)o4	ZINC000000071552	S(c1ccco1)c3nnc(c2ccccc2)n3c4ccccc4
CC3(C)CN(C1=CCCC1=O)c2cc(C(F)(F)F)ccc2S3	ZINC000000003459	O=C1CCC=C1N2CCSc3ccccc23
Cc3ccc(C(=O)N2N=C(c1cccnc1)C[C@@]2(O)C(F)(F)F)cc3	ZINC000000302759	O=C(N2CCC(c1cccnc1)=N2)c3ccccc3
COc3cccc(c2csc(c1cccnc1)n2)c3	ZINC000000003451	c3ccc(c2csc(c1cccnc1)n2)cc3
Fc4ccc(S(=O)(=O)N1C[C@H]3C[C@@H](C1)c2cccc(=O)n2C3)cc4	ZINC000000194051	O=c4cccc3C2CC(CN(S(=O)(=O)c1ccccc1)C2)Cn34
CC(=O)Nc3ccc(/N=C/c1ccccc1OCc2ccccc2)cc3	ZINC000000066191	C(Oc1ccccc1C=Nc2ccccc2)c3ccccc3
CCOC(=O)c3sc2nc(c1ccccc1OC)nc(C)c2c3C	ZINC000000124280	c3ccc(c2ncc1ccsc1n2)cc3
C[C@@H](Cc1ccc(O)cc1)N4CCC(N3CCC(C(=O)NC2CC2)CC3)CC4	ZINC000011700885	O=C(NC1CC1)C4CCN(C3CCN(CCc2ccccc2)CC3)CC4
CC(C)N3CCC(N2CC[N@@](Cc1cnn(C)c1C)C[C@H]2CCO)CC3	ZINC000071750703	C3CC(N2CCN(Cc1cn[nH]c1)CC2)CCN3
NC5CC(c4cc(N3CCN(Cc2ccc1OCOc1c2)CC3)nc(N)n4)C5	ZINC000219261614	C5CC(c4cc(N3CCN(Cc2ccc1OCOc1c2)CC3)ncn4)C5
Nc3ncnc4[nH]c(N2CCN(C(=O)c1ccccc1)CC2)nc34	ZINC000000052490	O=C(N3CCN(c2nc1cncnc1[nH]2)CC3)c4ccccc4
CCCN(CC(=O)N[C@@H](CCCNC(N)=N)C=O)C(=O)[C@H]1CCCCN1	ZINC000003823933	C1CCNCC1
CNCCNc2ccc3n(CCN)nc4c1c(O)ccc(O)c1c(=O)c2c34	ZINC000028759395	O=c2c1ccccc1c4n[nH]c3cccc2c34
Cc1cc(Br)cc(C)c1NC(=O)c2ccccc2F	ZINC000000036018	O=C(Nc1ccccc1)c2ccccc2
COc1ccccc1N4CCC([N@]3CC[C@@H](N2CCCCCC2)[C@H](O)C3)CC4	ZINC000011822135	C4CCCN(C3CCN(C2CCN(c1ccccc1)CC2)CC3)CC4
CCOC(=O)c3ccc(N2C(=O)C[C@H](N1CCC(O)CC1)C2=O)cc3	ZINC000000083163	O=C2CC(N1CCCCC1)C(=O)N2c3ccccc3
CN4CCN(Cn2c(=S)n(CN1CCN(C)CC1)c3ccccc23)CC4	ZINC000022036051	S=c3n(CN1CCNCC1)c2ccccc2n3CN4CCNCC4
CN3CCC(NC(=O)c2cc(C(=O)NC1CCN(C)CC1)n(C)n2)CC3	ZINC000020616957	O=C(NC1CCNCC1)c3cc(C(=O)NC2CCNCC2)[nH]n3
CC(=O)Nc3nc2ccc(NC(=O)c1ccc(N)cc1)cc2s3	ZINC000000033197	O=C(Nc2ccc1ncsc1c2)c3ccccc3
Cc1n[nH]c(C)c1n2c(=O)c4cccc3c(N(=O)=O)ccc(c2=O)c34	ZINC000000069865	O=c2n(c1cn[nH]c1)c(=O)c4cccc3cccc2c34
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c2cc(N(=O)=O)ccc2OC	ZINC000000042033	O=C2NC=CC(c1ccccc1)N2
CC3(C)O[C@H]2O[C@@H]([C@H](O)COC(=O)c1ccccc1)[C@@H](O)[C@H]2O3	ZINC000000042904	O=C(OCCC2CC1OCOC1O2)c3ccccc3
COc3ccc2c(=O)cc(c1ccccc1)oc2c3	ZINC000000018056	O=c2cc(c1ccccc1)oc3ccccc23
Cc2cc(NC(=O)c1c(C)cccc1C)no2	ZINC000000002071	O=C(Nc1ccon1)c2ccccc2
O=C3C[C@H](Sc2nc1CCCc1cc2C#N)C(=O)N3c4ccccc4	ZINC000000068396	O=C3CC(Sc2ccc1CCCc1n2)C(=O)N3c4ccccc4
CC(=O)c3ccc2OC1(CC1)C(=O)c2c3	ZINC000000002075	O=C2c1ccccc1OC23CC3
C[C@@H](O)CN3CCC(C[N@@](C)Cc2nn1c(=O)cc(C)nc1s2)CC3	ZINC000106125782	O=c2ccnc3sc(CNCC1CCNCC1)nn23
CCN3C(=O)[C@@](O)(CC(=O)c1cccc2ccccc12)c4ccccc34	ZINC000000319232	O=C(CC1C(=O)Nc2ccccc12)c3cccc4ccccc34
ONC(=O)CNC(=O)c1ccc(Cl)cc1	ZINC000000001008	c1ccccc1
CCOc3ccc(NC(=O)c1cc(CC(C)C)nc2ccccc12)cc3	ZINC000000241329	O=C(Nc1ccccc1)c2ccnc3ccccc23
Cc3ccc(NCn2c(=O)c1ccc(N(=O)=O)cc1c2=O)cc3	ZINC000000058978	O=c2n(CNc1ccccc1)c(=O)c3ccccc23
FC(F)(F)c3cccc(N2CCN(C(=O)Nc1ccccc1)CC2)c3	ZINC000000275358	O=C(Nc1ccccc1)N3CCN(c2ccccc2)CC3
Cc3cccc(SCC(=O)Nc2ccc(C1CCCCC1)cc2)c3	ZINC000000045128	O=C(CSc1ccccc1)Nc3ccc(C2CCCCC2)cc3
NCc4cn(C3CCN(Cc1cccnc1N2CCOCC2)CC3)nn4	ZINC000023369026	C4CN(c1ncccc1CN3CCC(n2ccnn2)CC3)CCO4
CN(C)C[C@H](O)CN2C(=O)N(CN1C(=O)N(C[C@H](O)CN(C)C)C(=O)C1(C)C)C(C)(C)C2=O	ZINC000009057266	O=C2CN(CN1CC(=O)NC1=O)C(=O)N2
CS(=O)(=O)C(=C/c2ccc(OCc1cc(F)cc(F)c1)cc2)/C#N	ZINC000000113065	C(Oc1ccccc1)c2ccccc2
Brc2ccc(C(=O)COC(=O)C=Cc1ccccc1)cc2	ZINC000000270598	O=C(OCC(=O)c1ccccc1)C=Cc2ccccc2
Cc1cccnc1n3c(C)nc2ccccc2c3=O	ZINC000000013747	O=c2n(c1ccccn1)cnc3ccccc23
C[C@@H](O)[C@@H](O)c1ccc(C#N)nc1	ZINC000000023802	c1ccncc1
Cc2ccc1nonc1c2N(=O)=O	ZINC000000029107	c2ccc1nonc1c2
Cc2cc(C(=O)C(=NNc1cccc(Cl)c1)C#N)n(C(C)(C)C)n2	ZINC000000122922	O=C(C=NNc1ccccc1)c2ccn[nH]2
O=c3c1ccccc1c4nc2nonc2nc34	ZINC000000027763	O=c3c1ccccc1c4nc2nonc2nc34
Cc2nc(c1noc(C)n1)no2	ZINC000000027765	c2nc(c1ncon1)no2
Clc3ccc(OC(=O)NN2CCc1ccccc1C2)cc3	ZINC000000027369	O=C(NN2CCc1ccccc1C2)Oc3ccccc3
O=C1CCCC3=C1[C@H](c2ccccn2)c4c(N3)ccc5ncccc45	ZINC000000054408	O=C1CCCC3=C1C(c2ccccn2)c4c(N3)ccc5ncccc45
CN3CCC(C)(C(=O)N2CCC[C@@H](Cn1cc(C(C)(C)N)nn1)C2)CC3	ZINC000048200622	O=C(C1CCNCC1)N3CCCC(Cn2ccnn2)C3
CCN4CCN(C(=O)c3ccc(N2CCC(N1CCC(OC)CC1)CC2)cc3)CC4	ZINC000014996085	O=C(N1CCNCC1)c4ccc(N3CCC(N2CCCCC2)CC3)cc4
COc2ccc([C@@H]1CNC(=O)C1)cc2OC3CCCC3	ZINC000000004982	O=C3CC(c2cccc(OC1CCCC1)c2)CN3
COC(=O)c1sc(=S)n(CC=C)c1N	ZINC000000075279	S=c1[nH]ccs1
O=C(N[C@H]1CN2CCC1CC2)c4c[nH]c3ccsc3c4=O	ZINC000000016869	O=C(NC1CN2CCC1CC2)c4c[nH]c3ccsc3c4=O
O=c2[nH]nc(c1cccnc1)c3ccccc23	ZINC000000005291	O=c2[nH]nc(c1cccnc1)c3ccccc23
C[C@H]2[C@H]3Cc1ccc(O)cc1[C@]2(C)CCN3	ZINC000000005296	C3CC1CC(Cc2ccccc12)N3
COc3ccc(CNC(=O)CSc2nc1ccccc1[nH]2)cc3	ZINC000000036127	O=C(CSc2nc1ccccc1[nH]2)NCc3ccccc3
COc3ccc2nc1ccccc1c(NCCNCCO)c2c3	ZINC000004428562	c3ccc2nc1ccccc1cc2c3
CNCCC[C@H](C)Nc1ccnc2cc(Cl)ccc12	ZINC000001596762	c2ccc1ncccc1c2
CN5CCN(c4ncc(c1cc(C)no1)c([C@@H]3CCCN(c2cc(C)nc(N)n2)C3)n4)CC5	ZINC000012184481	C5CC(c2nc(N1CCNCC1)ncc2c3ccno3)CN(c4ccncn4)C5
Cc2n(C)c1ccccc1[n+]2CCOCC[n+]3c(C)n(C)c4ccccc34	ZINC000003129839	C(C[n+]1c[nH]c2ccccc12)OCC[n+]3c[nH]c4ccccc34
O=C(Cn1cncc1c2ccc(N(=O)=O)cc2)N3CCOCC3	ZINC000000036238	O=C(Cn1cncc1c2ccccc2)N3CCOCC3
CN4CCN(Cc3ccc(C(=O)N2CCC(N1CCC(O)CC1)CC2)o3)CC4	ZINC000072151218	O=C(N2CCC(N1CCCCC1)CC2)c4ccc(CN3CCNCC3)o4
Fc3ccc(c2n/c(=C/c1ccccc1Br)c(=O)o2)cc3	ZINC000000055338	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
NCCn4cc(C(=O)NCc3cc2C[N@@](C1CCCCC1)CCn2n3)nn4	ZINC000077338168	O=C(NCc3cc2CN(C1CCCCC1)CCn2n3)c4c[nH]nn4
CNc2c1CCCCc1nn2C	ZINC000000000757	C2CCc1n[nH]cc1C2
O=C(CCN(CCCN1CCCCC1)S(=O)(=O)c2ccccc2)N3CCNCC3	ZINC000045945100	O=C(CCN(CCCN1CCCCC1)S(=O)(=O)c2ccccc2)N3CCNCC3
CN(C)c4nc(N2CCN(C1CCCCC1)CC2)nc3CCNCc34	ZINC000034676567	C4CCC(N3CCN(c2ncc1CNCCc1n2)CC3)CC4
CC(=O)OC(OC(C)=O)c1ccc(N(=O)=O)s1	ZINC000000036721	c1ccsc1
Cc2ccc(OCC(=O)Nc1cccc(N(=O)=O)c1C)cc2	ZINC000000038888	O=C(COc1ccccc1)Nc2ccccc2
CCOC(=O)c3oc2cc1c(C)c(C(=O)OCC)oc1cc2c3C	ZINC000000050401	c3cc2cc1occc1cc2o3
O=C(CSc1nnnn1c2ccccc2)N3CCNC3=O	ZINC000000117193	O=C(CSc1nnnn1c2ccccc2)N3CCNC3=O
CCOC(=O)C(CC#CCN(C)C)(CC#CCN(C)C)C(=O)OCC	ZINC000002945546	nonring
C[N@]2CC1(CCNCC1)C[C@H]2C(=O)NCCc4cn3nc(C)sc3n4	ZINC000072410027	O=C(NCCc2cn1ncsc1n2)C4CC3(CCNCC3)CN4
CCn2c(c1ccc(Cl)cc1)n[nH]c2=O	ZINC000000004188	O=c2[nH]nc(c1ccccc1)[nH]2
CCOC(=O)C2CCN(C(=O)Nc1cc(Cl)cc(Cl)c1)CC2	ZINC000000154277	O=C(Nc1ccccc1)N2CCCCC2
CSc2nc(c1ccccn1)nc(N)c2C#N	ZINC000000077434	c2ccc(c1ncccn1)nc2
O=C(Nc1ccccn1)c3nc2ccccc2[nH]3	ZINC000000009612	O=C(Nc1ccccn1)c3nc2ccccc2[nH]3
Nc3c2CC1CC(C1)c2nc4cccc(F)c34	ZINC000000004438	C1C4CC1c3nc2ccccc2cc3C4
Fc3ccc(C(=O)N2CCN(c1cccc(Cl)c1)CC2)cc3	ZINC000000047043	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
CCc3ccc(N[C@H]2CC(=O)N(c1ccc(Cl)cc1C)C2=O)cc3	ZINC000000342301	O=C2CC(Nc1ccccc1)C(=O)N2c3ccccc3
O=C(Cn2c(=O)c1ccccc1c2=O)NC[C@@H]3CCCO3	ZINC000000029094	O=C(Cn2c(=O)c1ccccc1c2=O)NCC3CCCO3
CC(C)(C)NS(=O)(=O)c2ccc(NC(=O)c1cccs1)cc2	ZINC000000073932	O=C(Nc1ccccc1)c2cccs2
Brc3cccc(C(=O)N(CCCN1CCCC1)CCC(=O)N2CCNCC2)c3	ZINC000035422018	O=C(CCN(CCCN1CCCC1)C(=O)c2ccccc2)N3CCNCC3
Nc2cc(Cl)nc(SCc1ccccc1)n2	ZINC000000021246	C(Sc1ncccn1)c2ccccc2
COc4cc(c1n[nH]cc1CN3CCC([C@@H](C)N2CCOCC2)CC3)cc(OC)c4OC	ZINC000012447451	C4CN(CC3CCN(Cc1c[nH]nc1c2ccccc2)CC3)CCO4
O=C(CC[C@H]2C[N@@](Cc1ccncc1)CC[C@H]2N3CCOCC3)NCCN4CCCCC4	ZINC000012190441	O=C(CCC2CN(Cc1ccncc1)CCC2N3CCOCC3)NCCN4CCCCC4
N[C@@H](C1CCC(O)CC1)C(O)=O	ZINC000000001869	C1CCCCC1
COc4ccc(c3cnc(c1c(O)c(C)nc2ccccc12)o3)cc4	ZINC000000053812	c4ccc(c3cnc(c1ccnc2ccccc12)o3)cc4
NC(=O)c2c(c1cccc(Br)c1)c(C#N)c(N)[nH]c2=S	ZINC000000120873	S=c2cc(c1ccccc1)cc[nH]2
Cn3c2OC(N)=C(C#N)[C@@H](c1ccccc1)c2c(=O)n(C)c3=O	ZINC000000062534	O=c3[nH]c2OC=CC(c1ccccc1)c2c(=O)[nH]3
NC(=O)c2cc(c1ccccc1)sc2NC(=O)CN3CCCCC3	ZINC000000090100	O=C(CN1CCCCC1)Nc3ccc(c2ccccc2)s3
COc5cc4cc[n+]3CC[n+]2ccc1cc(OC)c(OC)cc1c2c3c4cc5OC	ZINC000001564238	C3C[n+]2ccc1ccccc1c2c4[n+]3ccc5ccccc45
Clc2cc1[nH]c(=O)c(=O)[nH]c1cc2n3cccc3	ZINC000000017999	O=c3[nH]c2ccc(n1cccc1)cc2[nH]c3=O
C[C@H](C(=O)NC1CCCCC1)c2ccncc2	ZINC000000009589	O=C(Cc1ccncc1)NC2CCCCC2
CCOC(=O)C2=C(O)C(=O)N(c1ccccc1)[C@@H]2c3ccccc3	ZINC000000044657	O=C2C=CC(c1ccccc1)N2c3ccccc3
C[n+]2ccc1ccccc1c2c3[n+](C)ccc4ccccc34	ZINC000001564232	c4ccc3c(c1nccc2ccccc12)nccc3c4
Fc3ccc(N2C[C@@H](C(=O)OCC(=O)c1ccccc1)CC2=O)cc3	ZINC000000050895	O=C2CC(C(=O)OCC(=O)c1ccccc1)CN2c3ccccc3
C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3	ZINC000000031963	O=c3cccc2C1CNCC(C1)Cn23
O=c4cc3nc2[nH]c1ccccc1c2nn3c(=S)[nH]4	ZINC000000031966	O=c4cc3nc2[nH]c1ccccc1c2nn3c(=S)[nH]4
Cn2c(SCCN1CCCC1)nnc2[C@@H]3CCCN3	ZINC000005000663	C3CNC(c2nnc(SCCN1CCCC1)[nH]2)C3
Cc1cc(Br)ccc1OCC(=O)Nc2cccc(C#N)c2	ZINC000000142672	O=C(COc1ccccc1)Nc2ccccc2
CN3CCN(Nc2ncnc(NC1CC(C)(C)NC(C)(C)C1)c2N)CC3	ZINC000040756851	C3CC(Nc2cc(NN1CCNCC1)ncn2)CCN3
CC(=NNC1=NCCN1)c3cn(C2=NCCN2)nc3C	ZINC000013099555	C3CN=C(NN=Cc2cnn(C1=NCCN1)c2)N3
CC(=O)N[C@@]2(C(Cl)(Cl)Cl)Oc1ccc(Cl)cc1O2	ZINC000000045415	C2Oc1ccccc1O2
CCOC(=O)CN1CCNCCN(CC(=O)OCC)CCNCC1	ZINC000019362260	C1CNCCNCCNCCN1
COc3ccc(C(=O)Nc2ccc(N1CCN(C)CC1)cc2)cc3S(=O)(=O)NCCN(C)C	ZINC000009464740	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
CC(=O)Nc2nnc(c1ccc(Cl)cc1Cl)s2	ZINC000000035904	c2ccc(c1nncs1)cc2
COc4ccc(OC)c(Nc2nc1nonc1n3nnnc23)c4	ZINC000000056245	N(c1ccccc1)c3nc2nonc2n4nnnc34
CC(C)(C)OC(=O)CN1CCNCCNCCNCC1	ZINC000034496195	C1CNCCNCCNCCN1
CN(C)CCN(C[C@@H]2CCC[N@@](Cc1ccccc1F)C2)C(=O)Cn3cncn3	ZINC000012594209	O=C(Cn1cncn1)NCC3CCCN(Cc2ccccc2)C3
CCSc2nc1ccccc1n2CC(=O)Nc3c(C)cccc3C	ZINC000000067057	O=C(Cn1cnc2ccccc12)Nc3ccccc3
COc3ccc2cc(C(=O)Nc1cc(C)on1)sc(=O)c2c3OC	ZINC000000079344	O=C(Nc1ccon1)c3cc2ccccc2c(=O)s3
Nc1ccccc1\C=N/CC/N=C/c2ccccc2N	ZINC000002527954	C(CN=Cc1ccccc1)N=Cc2ccccc2
CCCN4CCC(NC(=O)C[C@H]3[N@@](Cc1cccc2ccccc12)CCNC3=O)CC4	ZINC000011951802	O=C(CC3N(Cc1cccc2ccccc12)CCNC3=O)NC4CCNCC4
CN(C)CCOc1ccccc1c3nc(c2ccccc2)no3	ZINC000000007363	c3ccc(c2noc(c1ccccc1)n2)cc3
C[N@@](CCN1CCNCC1)Cc3cc(=O)n2ccsc2n3	ZINC000071150510	O=c2cc(CNCCN1CCNCC1)nc3sccn23
CCN(CC)C(=O)CSc1ccc(Cl)nn1	ZINC000000000984	c1ccnnc1
C4CN=C(c3ccc(OCOc2ccc(C1=NCCN1)cc2)cc3)N4	ZINC000027526302	C4CN=C(c3ccc(OCOc2ccc(C1=NCCN1)cc2)cc3)N4
Cn3c1ccccc1c4cc2ccccc2c[n+]34	ZINC000000006766	c4ccc3c[n+]2[nH]c1ccccc1c2cc3c4
CCc3cccc(OCC(=O)NC(c1ccccc1)c2ccccc2)c3	ZINC000000145577	O=C(COc1ccccc1)NC(c2ccccc2)c3ccccc3
CN4CCN(C(=O)C[C@@H]1CCNC[C@@H]1Cc3cc(COc2ccccc2)on3)CC4	ZINC000015673588	O=C(CC1CCNCC1Cc3cc(COc2ccccc2)on3)N4CCNCC4
OC[C@H]1C[C@]1(CO)Cn2cc(C=CBr)c(=O)[nH]c2=O	ZINC000000006344	O=c2ccn(CC1CC1)c(=O)[nH]2
CCOC(=O)N1N=CC[C@@H]1C	ZINC000000025099	C1CC=NN1
NC(=O)c1ccccc1NC(=O)Nc2ccc(Cl)c(Cl)c2	ZINC000000017634	O=C(Nc1ccccc1)Nc2ccccc2
C[N@]3CCCN(c1ncccc1CNC[C@@H]2CCC=CC2)CC3	ZINC000011813728	C3CNCCN(c1ncccc1CNCC2CCC=CC2)C3
C[C@@H](CN(C)C)Oc2ccc(O[C@@H](C)CN(C)C)c3c(=O)c1ccccc1c(=O)c23	ZINC000004783347	O=c2c1ccccc1c(=O)c3ccccc23
O=S3(=O)N=C(N/N=C/c1ccccn1)c2ccccc23	ZINC000000033995	O=S3(=O)N=C(NN=Cc1ccccn1)c2ccccc23
FC(F)(F)c2ccc(NC(=O)Nc1ccc(C(F)(F)F)cc1)cc2	ZINC000000119109	O=C(Nc1ccccc1)Nc2ccccc2
COc2ccc(/C=C/C(=O)NC1CCCCC1)cc2	ZINC000000028323	O=C(NC1CCCCC1)C=Cc2ccccc2
O=C(CCCn2c(=O)c1ccccc1c2=O)N3CCc4ccccc34	ZINC000000047945	O=C(CCCn2c(=O)c1ccccc1c2=O)N3CCc4ccccc34
Cc2ccc(NC(=O)c1cnccn1)c(Br)c2	ZINC000000035596	O=C(Nc1ccccc1)c2cnccn2
O=C(Nc2ccc(C1=NCCN1)cc2)Nc4ccc(C3=NCCN3)cc4	ZINC000001682417	O=C(Nc2ccc(C1=NCCN1)cc2)Nc4ccc(C3=NCCN3)cc4
COc3ccc(NS(=O)(=O)c2ccc1n(C)c(=O)oc1c2)cc3	ZINC000000139755	O=c3[nH]c2ccc(S(=O)(=O)Nc1ccccc1)cc2o3
CN(C)CCn3c(=O)c(CN2CCN(c1ccccn1)CC2)cc4ccc(F)cc34	ZINC000012278955	O=c2[nH]c1ccccc1cc2CN4CCN(c3ccccn3)CC4
COc2cc(C(=O)NC(=S)Nc1ccccn1)cc(OC)c2OC	ZINC000000328779	O=C(NC(=S)Nc1ccccn1)c2ccccc2
OC(=O)\C=C\C(=O)N3CCN(C(c1ccccc1)c2ccccc2)CC3	ZINC000000319758	C3CN(C(c1ccccc1)c2ccccc2)CCN3
CCOC(=O)c2c(NC(=O)CN(C)C1CCN(C)CC1)sc3c2CC(C)(C)NC3(C)C	ZINC000002633093	O=C(CNC1CCNCC1)Nc3cc2CCNCc2s3
O=C(NCc1ccccc1)c3cc(C(=O)NCc2ccccc2)ncn3	ZINC000000014574	O=C(NCc1ccccc1)c3cc(C(=O)NCc2ccccc2)ncn3
CN3CCC(N2CCC(O)(c1ccc(Br)cc1)CC2)CC3	ZINC000000757910	C3CC(N2CCC(c1ccccc1)CC2)CCN3
COC(=O)c2ccc(CNCCCN1CCN(C)CC1)o2	ZINC000035046317	C(CNCc1ccco1)CN2CCNCC2
O[C@H]1COC[C@@H]1[N@]4CCCN(C(=O)CCc3cc2CNCCCn2n3)CC4	ZINC000072422872	O=C(CCc2cc1CNCCCn1n2)N4CCCN(C3CCOC3)CC4
CCc2c(C)sc(NC(=O)c1ccncc1)c2C(=O)OC	ZINC000000027960	O=C(Nc1cccs1)c2ccncc2
O=S(=O)(Cc1ccccc1)Nc3nc2ccccc2s3	ZINC000000029865	O=S(=O)(Cc1ccccc1)Nc3nc2ccccc2s3
Cc2ccnc3c(=O)c1c(Cl)ccnc1c(=O)c23	ZINC000000024231	O=c2c1cccnc1c(=O)c3cccnc23
CN(C)c2cc[n+](CC(O)C[n+]1ccc(N(C)C)cc1)cc2	ZINC000005342446	C(C[n+]1ccccc1)C[n+]2ccccc2
NC(=O)c1ccc(N(=O)=O)cc1Cl	ZINC000000000887	c1ccccc1
CSc3ccc(NC(=O)N(C[C@H]1CCCO1)Cc2ccco2)cc3	ZINC000000257747	O=C(Nc1ccccc1)N(CC2CCCO2)Cc3ccco3
O[C@@H](CNC2CCN(Cc1ccccc1)CC2)COC[C@@H]3CCCO3	ZINC000006083772	C(CNC2CCN(Cc1ccccc1)CC2)COCC3CCCO3
NC(=N)c3ccc(NC(=O)c2ccc(C(=O)Nc1ccc(C(N)=N)cc1)c(N)c2)cc3	ZINC000004821857	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
CN(C)CCCN4C(=O)N(CCc1ccccc1)C3(CCN(Cc2cnn(C)c2)CC3)C4=O	ZINC000014742152	O=C3NC(=O)C2(CCN(Cc1cn[nH]c1)CC2)N3CCc4ccccc4
O[C@H]3CCCN(C[C@H]2NC(=O)[C@@H](C[N@@]1CCC[C@H](O)C1)NC2=O)C3	ZINC000005385087	O=C2NC(CN1CCCCC1)C(=O)NC2CN3CCCCC3
OCC[C@H]3CN(c2ncnc1CCNCCc12)CC[N@]3Cc4ccoc4	ZINC000072480811	C4Cc3ncnc(N2CCN(Cc1ccoc1)CC2)c3CCN4
O=c3n(CCN2CCC(CN1CCOCC1)CC2)nc4ccccn34	ZINC000051959943	O=c3n(CCN2CCC(CN1CCOCC1)CC2)nc4ccccn34
O=C(NCc1cccnc1n2cncn2)[C@@H]4CC3(CCNCC3)CN4	ZINC000072166712	O=C(NCc1cccnc1n2cncn2)C4CC3(CCNCC3)CN4
O=C(NCCc1ccccc1)C4CCN(C3CCN(CCCn2cccn2)CC3)CC4	ZINC000012596206	O=C(NCCc1ccccc1)C4CCN(C3CCN(CCCn2cccn2)CC3)CC4
CN3CCN(c2ncc(Cn1ccnc1)s2)CC3	ZINC000004024736	C3CN(c2ncc(Cn1ccnc1)s2)CCN3
Cc4cccc(NC(=O)c2cc(c1ccc(C)o1)nc3ccccc23)c4	ZINC000000369047	O=C(Nc1ccccc1)c3cc(c2ccco2)nc4ccccc34
C3CN(Cc1ccccn1)c2ccccc2C3	ZINC000000024941	C3CN(Cc1ccccn1)c2ccccc2C3
C/N=C2\S[C@@H](C(=O)Nc1ccccc1F)CC(=O)N2C	ZINC000000032729	N=C2NC(=O)CC(C(=O)Nc1ccccc1)S2
O=C(N1CCc2ccccc12)c3c[nH]c4ncccc34	ZINC000000006618	O=C(N1CCc2ccccc12)c3c[nH]c4ncccc34
C[C@@H]3C[C@@]2(C)Oc1ccccc1C[C@H]2[C@H](C)[C@@H]3CNCCCN(C)C	ZINC000005028770	C3CCC2Oc1ccccc1CC2C3
COC(=O)c1sccc1OCc3nnc(c2ccc(OC)cc2)o3	ZINC000000127419	C(Oc1ccsc1)c3nnc(c2ccccc2)o3
CN5CCC(N4CCC[C@@H](N3CCN(Cc2ccc1OCOc1c2)CC3)C4)CC5	ZINC000020201190	C5CC(N3CCN(Cc2ccc1OCOc1c2)CC3)CN(C4CCNCC4)C5
COc3ccc([C@@H]1NC(=O)NC(C)=C1C(=O)OC2CCCC2)cc3	ZINC000000039357	O=C3NC=C(C(=O)OC1CCCC1)C(c2ccccc2)N3
COc2cccc([C@]1(O)CC[S@+](C)C[C@@H]1C[N+](C)(C)C)c2	ZINC000017185670	C2CC(c1ccccc1)CCS2
Cc4ccc(c3csc(Nc2ccc1OCOc1c2)n3)cc4C	ZINC000000066717	C4Oc3ccc(Nc2nc(c1ccccc1)cs2)cc3O4
Cc3nc(N)c(C[n+]2cc(CSc1ccccc1)c(N)nc2C)c[n+]3C	ZINC000015780575	C(Sc1ccccc1)c3cnc[n+](Cc2cncnc2)c3
NS(=O)(=O)c4ccc3N[C@H](c1ccc(F)cc1)[C@H]2CC=C[C@H]2c3c4	ZINC000000053178	C1C=CC3C1C(c2ccccc2)Nc4ccccc34
O=C(NCc1ccccn1)c3ccc(NC(=O)c2cccs2)cc3	ZINC000000052484	O=C(NCc1ccccn1)c3ccc(NC(=O)c2cccs2)cc3
CN4CCC([N@]3CCC[C@H](C(=O)NCc2nc1cc(C)c(C)cc1[nH]2)C3)CC4	ZINC000011814151	O=C(NCc2nc1ccccc1[nH]2)C4CCCN(C3CCNCC3)C4
O=NN1CC[N+]3(CC1)CC[N+]2(CCN(N=O)CC2)CC3	ZINC000005377009	C1C[N+]3(CCN1)CC[N+]2(CCNCC2)CC3
NC(=N)NC(=N)Nc2cccc(S(=O)(=O)N1CCOCC1)c2	ZINC000005616289	O=S(=O)(N1CCOCC1)c2ccccc2
CCOc3ccc(NC(=O)[C@@H]2CC(=O)NC(N1CCN(C)CC1)=N2)cc3	ZINC000019533529	O=C3CC(C(=O)Nc1ccccc1)N=C(N2CCNCC2)N3
C[N+](C)(N)CCOC(=O)[C@](O)(C1CCCCC1)c2ccccc2	ZINC000002024179	C2CCC(Cc1ccccc1)CC2
Cc3cccc(CN2CCC(N1CCCC1)CC2)c3	ZINC000004745767	C3CCN(C2CCN(Cc1ccccc1)CC2)C3
CC(C)COC(=O)C1=C(C)NC(=S)N[C@@H]1c2cccc(N(=O)=O)c2	ZINC000000193876	S=C2NC=CC(c1ccccc1)N2
CCOc3ccc(N2C(=O)C[C@H](Cc1ccc(Cl)cc1)C2=O)cc3	ZINC000000281395	O=C2CC(Cc1ccccc1)C(=O)N2c3ccccc3
COC(=O)C3[C@@H](c1ccc(N(=O)=O)cc1)n2nnnc2N=C3C	ZINC000000071011	C2C=Nc1nnnn1C2c3ccccc3
O=C(c1cccs1)c2non(=O)c2C(=O)c3cccs3	ZINC000000047830	O=C(c1cccs1)c2non(=O)c2C(=O)c3cccs3
C[C@@H](Nc2nc1nonc1nc2N3CCCC3)c4ccccc4	ZINC000000033526	C4CCN(c2nc1nonc1nc2NCc3ccccc3)C4
CN(C)c2ncnc3n(Cc1ccccc1)cnc23	ZINC000000002918	C(c1ccccc1)n2cnc3cncnc23
CCCn2ncc(CN1CCO[C@@H](CCN(C)C)C1)c2C	ZINC000012705994	C2CN(Cc1cn[nH]c1)CCO2
Fc4cccc(CSc1nnnn1c3ccc2OCOc2c3)c4	ZINC000000033523	C4Oc3ccc(n1nnnc1SCc2ccccc2)cc3O4
Clc3ccc(CSc1ccccc1/N=C/c2cccs2)cc3	ZINC000000173000	C(Sc1ccccc1N=Cc2cccs2)c3ccccc3
COCCc3nc(CNC(=O)[C@@H]2CC1(CCNCC1)CN2)no3	ZINC000072156766	O=C(NCc1ncon1)C3CC2(CCNCC2)CN3
COc2ccc(NC(=O)CN(c1ccc(C)cc1)S(C)(=O)=O)cc2	ZINC000000281469	O=C(CNc1ccccc1)Nc2ccccc2
CC(C)[C@@H](O)CN4CCN(Cc3nc(C(=O)N2CCN(C1CCCC1)CC2)co3)CC4	ZINC000034677817	O=C(N2CCN(C1CCCC1)CC2)c4coc(CN3CCNCC3)n4
Nc1ccc(S(N)(=O)=O)cc1	ZINC000000002101	c1ccccc1
Clc3ccc(COn1nnc2ccccc12)c(Cl)c3	ZINC000000047703	C(On1nnc2ccccc12)c3ccccc3
COc2ccc(\C=N\c1ccc(Br)cc1)c3ccccc23	ZINC000000065176	C(=Nc1ccccc1)c2cccc3ccccc23
Cc3ncc(CN2CCN(c1cnn(C)c(=O)c1)CC2)n3C	ZINC000020598142	O=c3cc(N2CCN(Cc1cnc[nH]1)CC2)cn[nH]3
CN4CCN(c3cc(C)nc([C@@H]2CCN(C(=O)c1cnn(C)c1)C2)c3)CC4	ZINC000019739082	O=C(N3CCC(c2cc(N1CCNCC1)ccn2)C3)c4cn[nH]c4
COc1ccc(C)cc1NC(=O)Cn2c(=O)oc3cc(Cl)ccc23	ZINC000000212487	O=C(Cn1c(=O)oc2ccccc12)Nc3ccccc3
CCCCN1CCOCCOCCN(CCCC)CCOCCOCC1	ZINC000005419645	C1COCCOCCNCCOCCOCCN1
Cc2[nH]c1ccccc1c2CCNC(=O)c3cc(F)c(F)cc3Cl	ZINC000000032812	O=C(NCCc1c[nH]c2ccccc12)c3ccccc3
NCC(CN1CCCCC1)(c2ccccc2)c3ccccc3	ZINC000001603019	C3CCN(CC(c1ccccc1)c2ccccc2)CC3
O=C(Cc1cccs1)Nc4ccc(c3nc2ccccc2o3)cc4	ZINC000000051300	O=C(Cc1cccs1)Nc4ccc(c3nc2ccccc2o3)cc4
COc2cc(CNC1CCN(C)CC1)cc3OCCOc23	ZINC000017314072	C3CC(NCc2ccc1OCCOc1c2)CCN3
CCCC(=O)NCc3cc(c1nn(C)c(=O)c2ccccc12)ccc3C	ZINC000000204037	O=c2[nH]nc(c1ccccc1)c3ccccc23
CC(C)=CCN3CCC2(CC[C@@H](CNC(=O)c1cn(CCN)nn1)O2)CC3	ZINC000077407186	O=C(NCC2CCC1(CCNCC1)O2)c3c[nH]nn3
Nc2ccc(S(=O)(=O)c1ccc(N)cn1)cc2	ZINC000000002008	O=S(=O)(c1ccccc1)c2ccccn2
C[N+]2(CCNC(=O)C(=O)NCC[N+]1(C)CCCCCC1)CCCCCC2	ZINC000005022288	O=C(NCCN1CCCCCC1)C(=O)NCCN2CCCCCC2
CC(=O)N(c2ccc(C1CCCCC1)cc2)c3nc(C)cc(C)c3C#N	ZINC000000069700	C3CCC(c2ccc(Nc1ccccn1)cc2)CC3
CCOC(=O)[C@]13CCCN[C@@H]1CCN(C(=O)c2cn(CCN)nn2)C3	ZINC000072171426	O=C(N2CCC1NCCCC1C2)c3c[nH]nn3
Nc2nc(F)cc(Oc1ccc(I)cc1)n2	ZINC000000033290	O(c1ccccc1)c2ccncn2
O=c3n(c2nc1ccccc1s2)c(=O)c5cccc4cccc3c45	ZINC000000047062	O=c3n(c2nc1ccccc1s2)c(=O)c5cccc4cccc3c45
C5CNCc4cc(C[N@@]3CCc2nnc(Cc1cccnc1)n2CC3)nn4C5	ZINC000072158485	C5CNCc4cc(CN3CCc2nnc(Cc1cccnc1)n2CC3)nn4C5
Cc1ccccc1C(=O)Oc3ccc(OC(=O)c2ccccc2C)cc3	ZINC000000058944	O=C(Oc2ccc(OC(=O)c1ccccc1)cc2)c3ccccc3
Cc4ccc3oc(c2cccc(NC(=O)c1cccs1)c2C)nc3c4	ZINC000000174590	O=C(Nc3cccc(c2nc1ccccc1o2)c3)c4cccs4
O=C3N2Cc1ccccc1C(=O)N2Cc4ccccc34	ZINC000000001296	O=C3N2Cc1ccccc1C(=O)N2Cc4ccccc34
CC(C)N3CCC(N2CC[N@@](CCCn1cccn1)C[C@@H]2CCO)CC3	ZINC000019836836	C(CN2CCN(C1CCNCC1)CC2)Cn3cccn3
ON(N=[O+]c1ccc(N(=O)=O)cc1N(=O)=O)N2CCNCC2	ZINC000040565926	C2CN(NN=[O+]c1ccccc1)CCN2
Clc2nc1cc(N(=O)=O)c(Cl)cc1[nH]2	ZINC000000018263	c2ccc1[nH]cnc1c2
CC3(C)O[C@@H]2CO[C@@]1(CNC(=N)NC(N)=N)OC(C)(C)O[C@@H]1[C@@H]2O3	ZINC000026190130	C3OC2COC1OCOC1C2O3
CN(c1ccccc1)S(=O)(=O)c2ccc(F)cc2	ZINC000000029464	O=S(=O)(Nc1ccccc1)c2ccccc2
CC2(C)N=C(N)NC(NCCCOc1ccc(N(=O)=O)cc1)=N2	ZINC000001577779	C(CNC1=NCN=CN1)COc2ccccc2
CC(C)c1nccn1CC(=O)N4CCc3nc([C@@H]2CCCN2)ncc3C4	ZINC000019454384	O=C(Cn1ccnc1)N4CCc3nc(C2CCCN2)ncc3C4
CN(/N=C/c1ccccc1F)C2=NS(=O)(=O)c3ccccc23	ZINC000000032020	O=S3(=O)N=C(NN=Cc1ccccc1)c2ccccc23
CCN3CCN(CCCN[C@@H]2CC(=O)N(c1ccc(Br)cc1)C2=O)CC3	ZINC000022581945	O=C2CC(NCCCN1CCNCC1)C(=O)N2c3ccccc3
Clc3ccc(CSc2nc1ccccc1c(=O)[nH]2)c(Cl)c3	ZINC000000068812	O=c2[nH]c(SCc1ccccc1)nc3ccccc23
N(c1ccccc1)c3nc2nonc2n4cnnc34	ZINC000000053197	N(c1ccccc1)c3nc2nonc2n4cnnc34
CC[C@@H]1CCCCN1c3c(Cl)c(=O)n(c2ccc(OC)cc2)c3=O	ZINC000000121704	O=c2cc(N1CCCCC1)c(=O)n2c3ccccc3
CCn1ccnc1C[N@]3CCC[C@H](CCC(=O)N(C)C2CCN(C)CC2)C3	ZINC000012209559	O=C(CCC2CCCN(Cc1ncc[nH]1)C2)NC3CCNCC3
COC(=O)C(C(=O)OC)c1c(N(=O)=O)c(=O)n(C)c2ccccc12	ZINC000000086099	O=c2ccc1ccccc1[nH]2
Cc4nc(CNc3nc(N)nc2CC[N@@](C1CCNCC1)CCc23)no4	ZINC000072424563	C4CC(N3CCc2ncnc(NCc1ncon1)c2CC3)CCN4
C[C@@H]4CN=C(c3ccc(NC(=O)Nc2ccc(C1=NC[C@@H](C)N1)cc2)cc3)N4	ZINC000001691650	O=C(Nc2ccc(C1=NCCN1)cc2)Nc4ccc(C3=NCCN3)cc4
O=c4[nH]c3c2cccc(c1ccccc1)c2Cc3n5ccnc45	ZINC000000018316	O=c4[nH]c3c2cccc(c1ccccc1)c2Cc3n5ccnc45
Clc1ccccc1\C=c3\sc2nc(=O)cnn2c3=O	ZINC000000055699	O=c3cnn2c(=O)c(=Cc1ccccc1)sc2n3
NS(=O)(=O)c2ccc(NC(=O)c1cc(Cl)cc(Cl)c1)cc2	ZINC000000155281	O=C(Nc1ccccc1)c2ccccc2
CCn2cc(C(=O)Nc1ccc(C(C)C)cc1)c(=O)c3ccc(C)nc23	ZINC000000215447	O=C(Nc1ccccc1)c3c[nH]c2ncccc2c3=O
CC(C)(C(=O)c1cccnc1)c2cccnc2	ZINC000000001728	O=C(Cc1cccnc1)c2cccnc2
CNCCCNCc1cc(Cl)c(OCC(N)=O)c(OC)c1	ZINC000005322655	c1ccccc1
Cc3nn(c1ccccc1)c4NC(=O)CS[C@H](c2ccccc2)c34	ZINC000000054340	O=C4CSC(c1ccccc1)c3cnn(c2ccccc2)c3N4
CN(C)C[C@]1(C)OC(=O)C(Cl)=C1C	ZINC000000085686	O=C1OCC=C1
CN4CCN(c3nccc(CN2C[C@@H]1CCC[N@]1C[C@@H]2CCO)n3)CC4	ZINC000019590147	C4CC3CN(Cc2ccnc(N1CCNCC1)n2)CCN3C4
CN(C)CCO[C@H](NC(=O)OCCN(C)C)C(Cl)(Cl)Cl	ZINC000003167902	nonring
COc4cccc(C(=O)Nc3cccc(c2cn1ccccc1n2)c3)c4	ZINC000000245502	O=C(Nc3cccc(c2cn1ccccc1n2)c3)c4ccccc4
CCCC(=O)N2[C@@H](C)C[C@H](Nc1ccccc1C)c3cccc(C)c23	ZINC000000075515	C3CC(Nc1ccccc1)c2ccccc2N3
NC(=O)COc1cc(OCC(N)=O)c3c(c1)oc(=O)c2ccccc23	ZINC000000134008	O=c2oc1ccccc1c3ccccc23
C[N@]4C[C@H]1CNC[C@@]1(C(=O)NCCc3cn2nc(C)sc2n3)C4	ZINC000065369965	O=C(NCCc2cn1ncsc1n2)C34CNCC3CNC4
COC(=O)CCC(=O)N1CCC[C@@H]([N@@](C)CCCN(C)C)C1	ZINC000012443767	C1CCNCC1
NC(=O)c2ccc(NC(=O)Cc1ccc(Br)cc1)cc2	ZINC000000030771	O=C(Cc1ccccc1)Nc2ccccc2
COc2ccc(CCCC(=O)Nc1cc(Cl)ccc1OC)cc2C	ZINC000000366310	O=C(CCCc1ccccc1)Nc2ccccc2
COc2cccc(C(=O)Nc1ccc(C(C)=O)cc1)c2	ZINC000000029082	O=C(Nc1ccccc1)c2ccccc2
CN1CCC[C@@H]1CCNC(=O)[C@@H]4C[C@H](COc2cccnc2)C[N@@](Cc3ccncc3)C4	ZINC000014753904	O=C(NCCC1CCCN1)C4CC(COc2cccnc2)CN(Cc3ccncc3)C4
COc3cc(OC)cc(C(=O)N(CCN1CCCCC1)CCC(=O)N2CCNCC2)c3	ZINC000035422060	O=C(CCN(CCN1CCCCC1)C(=O)c2ccccc2)N3CCNCC3
Clc3ccc(CSc2cc1c(=O)[nH]c(=O)c1cc2N(=O)=O)cc3	ZINC000000093648	O=c2[nH]c(=O)c3cc(SCc1ccccc1)ccc23
C/C=C1\[C@H]3CCC[C@]1(N)c2ccc(=O)[nH]c2C3	ZINC000000007990	C=C1C3CCCC1c2ccc(=O)[nH]c2C3
Cc3nnc(SCCNC(=O)C12CNCC1CNC2)s3	ZINC000065395901	O=C(NCCSc1nncs1)C23CNCC2CNC3
Cc2nc(C)c(c1nnco1)cc2c3nnco3	ZINC000000033660	c3nnc(c2cncc(c1nnco1)c2)o3
Cc3ccc(NC(=O)c2c(C)nn(c1ccccc1)c2Cl)c(C)c3	ZINC000000044664	O=C(Nc1ccccc1)c3cnn(c2ccccc2)c3
Cc1nccn1c4ccc(CN3C[C@@H]2CCC[N@]2C[C@@H]3CCO)cc4	ZINC000019288261	C4CC3CN(Cc2ccc(n1ccnc1)cc2)CCN3C4
C[C@@H](NC(=O)[C@H]2CN(c1ccc(Cl)cc1)C(=O)C2)c3ccccc3	ZINC000000050882	O=C2CC(C(=O)NCc1ccccc1)CN2c3ccccc3
CC(C)Nc3nc(N1CCOCC1)nc(N2CCOCC2)n3	ZINC000000272524	C3CN(c2ncnc(N1CCOCC1)n2)CCO3
Cc4cc3c(=O)n(Cc2cccc(Oc1ccccc1)c2)cnc3s4	ZINC000000151055	O=c3n(Cc2cccc(Oc1ccccc1)c2)cnc4sccc34
COc3ccc(c2cc1c(OC)cc(OC)cc1[nH]c2=O)cc3	ZINC000000008649	O=c2[nH]c1ccccc1cc2c3ccccc3
Cc2ccc(OCC(=O)Nc1ccc(C)cc1Br)cc2	ZINC000000063650	O=C(COc1ccccc1)Nc2ccccc2
O=C(COC(=O)c1ccco1)OCn3c(=O)c2ccccc2c3=O	ZINC000000062257	O=C(COC(=O)c1ccco1)OCn3c(=O)c2ccccc2c3=O
CCN(CC)CCCNCc1cn(C)c(=O)n(C)c1=O	ZINC000020090550	O=c1cc[nH]c(=O)[nH]1
C[N@]1CC[C@@]3(C)C[C@@H](C1)Cc2ccc(O)cc23	ZINC000000000254	C1CC2CC(CN1)Cc3ccccc23
Cn3c1ccccc1c4nnc(SCC(=O)c2ccccc2)nc34	ZINC000000062258	O=C(CSc1nnc3c(n1)[nH]c2ccccc23)c4ccccc4
Cc2nn(C(=O)c1ccn(C)n1)c(C)c2Cl	ZINC000000037176	O=C(c1cc[nH]n1)n2cccn2
C[C@@H]2[C@@H]4N(CC1CC1)CC[C@@]2(C)c3cc(O)ccc3C4=O	ZINC000000000410	O=C3C1CC(CCN1CC2CC2)c4ccccc34
COc3cccc(\C=c2/c(=O)[nH]n(c1ccc(C)c(Cl)c1)c2=O)c3	ZINC000000068938	O=c2[nH]n(c1ccccc1)c(=O)c2=Cc3ccccc3
CN3CCN(CCCN(CCC(=O)N1CCNCC1)S(=O)(=O)c2cccc(F)c2)CC3	ZINC000045945069	O=C(CCN(CCCN1CCNCC1)S(=O)(=O)c2ccccc2)N3CCNCC3
NCCCc4nc3ccc(c2ccc1nc(CCCN)[nH]c1c2)cc3[nH]4	ZINC000004115445	c2cc1nc[nH]c1cc2c4ccc3nc[nH]c3c4
Cc2nn(c1ccccc1)nc2CNC(=O)C4=Cc3ccccc3OC4	ZINC000000131698	O=C(NCc2cnn(c1ccccc1)n2)C4=Cc3ccccc3OC4
CCOc1c(OC)cccc1\C=c3/c(C)nn(c2ccccc2)c3=O	ZINC000000035931	O=c2n(c1ccccc1)ncc2=Cc3ccccc3
COc2ccc(c1csc(=S)s1)cc2	ZINC000000011241	S=c2scc(c1ccccc1)s2
CCOC(=O)c2cc(c1csc(CS(C)(=O)=O)n1)on2	ZINC000000123723	c2cc(c1cscn1)on2
CCOC(=O)c4ccc3N[C@H](c1cccnc1)[C@H]2CC=C[C@H]2c3c4	ZINC000000037714	C1C=CC3C1C(c2cccnc2)Nc4ccccc34
CN(C)CCC(=O)C(=Cc1ccco1)C(=O)CCN(C)C	ZINC000001585820	c1ccoc1
O=C(Nc1nccs1)c2ccccc2N(=O)=O	ZINC000000031352	O=C(Nc1nccs1)c2ccccc2
O=C4C=CC2(CC1(CCCCC1)N=C2SCc3ccccc3)C=C4	ZINC000000056260	O=C4C=CC2(CC1(CCCCC1)N=C2SCc3ccccc3)C=C4
CCOC(=O)c2nn(c1ccc(OC)cc1)c(=N/C(C)=O)/s2	ZINC000000075693	N=c1scnn1c2ccccc2
CCOC(=O)c2nn(c1ccccc1N(=O)=O)c(=N/C(C)=O)/s2	ZINC000000075699	N=c1scnn1c2ccccc2
Cn1cnnc1c2cccc(F)c2	ZINC000000006371	c2ccc(c1nnc[nH]1)cc2
CC1(C)NC(=N)NC(=N)N1c2ccc(N(CCO)CCO)cc2	ZINC000001671007	N=C2NCN(c1ccccc1)C(=N)N2
Cn2nc(C(=O)Nc1ccccc1)cc2C(=O)Nc3ccccc3	ZINC000000044289	O=C(Nc1ccccc1)c3cc(C(=O)Nc2ccccc2)[nH]n3
Nc1nnnn1N=Cc2c[nH]nc2c3ccccc3	ZINC000000051937	C(=Nn1cnnn1)c2c[nH]nc2c3ccccc3
C[N+](C)(C)CC(=O)OCCOCCOC(=O)C[N+](C)(C)C	ZINC000011917704	nonring
Cc3cccc(CSCc2ccc(C(=O)NC1CCCCC1)o2)c3	ZINC000000263169	O=C(NC1CCCCC1)c3ccc(CSCc2ccccc2)o3
C[N@@](CCN1CCNCC1)Cc2cc(=O)n(C)c(=O)n2C	ZINC000071150831	O=c2cc(CNCCN1CCNCC1)[nH]c(=O)[nH]2
CCN(CC)Cc3cnc2c(C(=O)N1CC[N@@](C)[C@@H](CCO)C1)cnn2c3	ZINC000067713801	O=C(N1CCNCC1)c2cnn3cccnc23
O=C(CSc2nnc(c1ccco1)o2)Nc3cccc(N(=O)=O)c3	ZINC000000063937	O=C(CSc2nnc(c1ccco1)o2)Nc3ccccc3
C2CN=C(SC/C=C/CSC1=NCCN1)N2	ZINC000002312676	C2CN=C(SCC=CCSC1=NCCN1)N2
COc4ccc(N3CN=c2s\c(=C/c1ccco1)c(=O)n2C3)cc4	ZINC000000088159	O=c3n2CN(c1ccccc1)CN=c2sc3=Cc4ccco4
N=C1NC[C@H]3N1c2ccccc2Cc4ccccc34	ZINC000000006157	N=C1NCC3N1c2ccccc2Cc4ccccc34
O=N(=O)c3ccc(\C=N\NC1=NS(=O)(=O)c2ccccc12)o3	ZINC000000084642	O=S3(=O)N=C(NN=Cc1ccco1)c2ccccc23
COc3ccc2nc1n[nH]c(C)c1c(Cl)c2c3	ZINC000000006159	c3ccc2nc1n[nH]cc1cc2c3
CCOC(=O)c3nn(c2ccc1OCOc1c2)cc3O	ZINC000000087445	C3Oc2ccc(n1cccn1)cc2O3
CC(C)NC(=O)[C@@H]2C[N@@](Cc1ccccc1)C[C@@]24CCc3ccccc3[C@@H]4NC(=O)CN	ZINC000019449790	C3CC2(CCc1ccccc1C2)CN3Cc4ccccc4
C[C@@H](NC(=O)N(CCN(C)C)CCN(C)C)c1nnnn1c2ccccc2	ZINC000077831991	c2ccc(n1cnnn1)cc2
CCOc2ccc(n1cnnn1)cc2S(=O)(=O)N3CCCCC3	ZINC000000116924	O=S(=O)(N1CCCCC1)c3cccc(n2cnnn2)c3
COc1ccc(C(\C)=N\O)c(OC)c1OC	ZINC000000025880	c1ccccc1
CN(C)c2ccc(NC(=O)c1c(Cl)ccc(Cl)c1Cl)cc2	ZINC000000118376	O=C(Nc1ccccc1)c2ccccc2
NC(=N)c4cc3nc(c2cccc(O[C@@H]1CCNC1)c2O)[nH]c3cc4F	ZINC000013444375	C4CC(Oc3cccc(c2nc1ccccc1[nH]2)c3)CN4
COc1cc(OC)c(OC)cc1CNC2CCN(C)CC2	ZINC000017313832	C2CC(NCc1ccccc1)CCN2
Clc3ccc(NCn2nnc(c1ccc(N(=O)=O)cc1)n2)cc3	ZINC000000032939	C(Nc1ccccc1)n3nnc(c2ccccc2)n3
CN(Cc2cccc(OC[C@H](O)C[N@@](C)C1CCCCC1)c2)Cc3cnccn3	ZINC000012072496	C3CCC(NCCCOc2cccc(CNCc1cnccn1)c2)CC3
C[N@]5CCCN(C(=O)c2nc1sccn1c2CNC[C@@H]3OCCc4ccccc34)CC5	ZINC000020211380	O=C(N1CCCNCC1)c3nc2sccn2c3CNCC4OCCc5ccccc45
COc3ccc(NC(=O)C(c1ccccc1)c2ccccc2)c(OC)c3	ZINC000000060388	O=C(Nc1ccccc1)C(c2ccccc2)c3ccccc3
CCOC(=O)Nc1cccc2nsnc12	ZINC000000034329	c2ccc1nsnc1c2
COc2cccc3ccc1c(C#N)cc(N(=O)=O)cc1oc23	ZINC000000034458	c3ccc2oc1ccccc1ccc2c3
CN(C)CCCNC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1	ZINC000004957277	C1CCNCC1
Fc4ccc(C(=O)Nc3ccc(c2nc1ncccc1o2)cc3)cc4	ZINC000000038198	O=C(Nc3ccc(c2nc1ncccc1o2)cc3)c4ccccc4
Nc2cc(=O)n(Cc1ccccc1)c(=O)n2c3cccc(N(=O)=O)c3	ZINC000000170905	O=c2ccn(c1ccccc1)c(=O)n2Cc3ccccc3
CN2CCN(C(C)(C)CNCc1c(C)nn(C)c1Cl)CC2	ZINC000030664137	C2CN(CCNCc1cn[nH]c1)CCN2
Cc3ccc(n2c(SCC(N)=O)nc1CCSc1c2=O)cc3	ZINC000000213948	O=c2c1SCCc1ncn2c3ccccc3
NS(=O)(=O)c3ccc(NC(=S)N2CCc1ccccc1C2)cc3	ZINC000000193887	S=C(Nc1ccccc1)N3CCc2ccccc2C3
Cc3cc2N[C@@H](CC(=O)NCc1ccccc1)C(=O)Nc2cc3C	ZINC000000046725	O=C(CC2Nc1ccccc1NC2=O)NCc3ccccc3
CN(C)CC[C@H]3C[N@@](Cc1cn(C)nc1c2ccccc2)CCO3	ZINC000011841041	C3CN(Cc1c[nH]nc1c2ccccc2)CCO3
O=C(Nc2ccc(N1CCCCC1)cc2)c4ccc3ccccc3c4	ZINC000000038194	O=C(Nc2ccc(N1CCCCC1)cc2)c4ccc3ccccc3c4
CC(=O)\C=C\c1ccc(O)c(O)c1	ZINC000000005614	c1ccccc1
CN(C)CCn2cnc1n(CCN(C)C)c(C)c(C)c1c2=N	ZINC000006670454	N=c1[nH]cnc2[nH]ccc12
CN(C)C(=O)Cc2c(c1ccc(C)cc1)nc3ccc(C)cn23	ZINC000000003876	c3ccc(c2cn1ccccc1n2)cc3
Fc2ccc(C(=O)NC1(C(Cl)(Cl)Cl)OCCO1)cc2	ZINC000000045394	O=C(NC1OCCO1)c2ccccc2
CCN2CCN([C@@H](CN)c1cc(Br)cs1)CC2	ZINC000020475239	C2CN(Cc1cccs1)CCN2
FC(F)(F)C3(NC(=O)Nn1cnnc1)Oc2ccccc2O3	ZINC000000045396	O=C(NC2Oc1ccccc1O2)Nn3cnnc3
NCCn4cc(C(=O)N3CCC([N@]2CCC[C@@H](C(=O)NC1CC1)C2)CC3)nn4	ZINC000071589645	O=C(NC1CC1)C4CCCN(C3CCN(C(=O)c2c[nH]nn2)CC3)C4
COC(=O)c1c(C)oc(C)c1S(=O)(=O)N2CCCc3ccccc23	ZINC000000157257	O=S(=O)(N1CCCc2ccccc12)c3ccoc3
Fc3ccc(CSc1nncn1NCc2ccc(Cl)cc2)cc3	ZINC000000359855	C(Nn1cnnc1SCc2ccccc2)c3ccccc3
COc1cc(N)c(Cl)cc1C(=O)NCc2ccncc2	ZINC000000023009	O=C(NCc1ccncc1)c2ccccc2
NC(=N)NN=C(C[n+]1ccccc1)c2ccc(N(=O)=O)cc2	ZINC000006567673	N=C(C[n+]1ccccc1)c2ccccc2
CC[C@@]4(c1ccccc1)Oc2cccnc2n3cccc3C4=O	ZINC000000009136	O=C3C(c1ccccc1)Oc2cccnc2n4cccc34
CN4CCC([N@]3CCC[C@@H](C(=O)NC(C1CC1)C2CC2)C3)CC4	ZINC000014980814	O=C(NC(C1CC1)C2CC2)C4CCCN(C3CCNCC3)C4
CN4[C@@H]3N=C(N1CC[C@H](N)C1)N(Cc2ccccc2)[C@@H]3C(=O)N(C)C4=O	ZINC000036350319	O=C4NC3N=C(N1CCCC1)N(Cc2ccccc2)C3C(=O)N4
CCN2C(=O)N[C@@H](c1ccccc1N(=O)=O)C(C(=O)OC(C)C)=C2C	ZINC000000126738	O=C2NC=CC(c1ccccc1)N2
O=C1OCC[C@@H]3[C@@H]1[C@H]2CCC[N@@]2C35CCN(Cc4ccccc4)CC5	ZINC000004722431	O=C1OCCC3C1C2CCCN2C35CCN(Cc4ccccc4)CC5
COCc2cc(C)nc(SCC(=O)c1ccc(C)cc1C)c2C#N	ZINC000000049762	O=C(CSc1ccccn1)c2ccccc2
C3CCN(C[C@@H]2CO[C@H](CN1CCCCC1)CO2)CC3	ZINC000005375637	C3CCN(CC2COC(CN1CCCCC1)CO2)CC3
COc1ccccc1NC(=O)Cn2cnc(N(=O)=O)n2	ZINC000000076413	O=C(Cn1cncn1)Nc2ccccc2
Oc1ccc(F)cc1C4=NN[C@@H](c3cc(Cl)cc2COCOc23)C4	ZINC000000311787	C4OCc3cccc(C2CC(c1ccccc1)=NN2)c3O4
CN4CCN([C@H]1COC[C@@H]1Nc3nc(N(C)C)nc2CNCCc23)CC4	ZINC000067588408	C4CN(C1COCC1Nc3ncnc2CNCCc23)CCN4
O[C@@]1(C(F)(F)F)C=C(C(F)(F)F)NN1C(=O)c2ccccc2	ZINC000000052748	O=C(N1CC=CN1)c2ccccc2
O=C(c1ccccc1)c2non(=O)c2C(=O)c3ccccc3	ZINC000000047800	O=C(c1ccccc1)c2non(=O)c2C(=O)c3ccccc3
C[C@H]3CN(C(=O)c1ccccc1F)C(=N/c2ccccc2Cl)/S3	ZINC000000357828	O=C(N1CCSC1=Nc2ccccc2)c3ccccc3
NON3[C@@H](c1ccccc1)CC(c2ccccc2)C[C@@H]3c4ccccc4	ZINC000000046821	C3C(c1ccccc1)CC(c2ccccc2)NC3c4ccccc4
Cc2cc(=O)oc3ccc(OCC(=O)N1CCOCC1)cc23	ZINC000000049162	O=C(COc2ccc1oc(=O)ccc1c2)N3CCOCC3
O=N(=O)c2cccc3c(=O)n(CNc1ccccc1)c(=O)c23	ZINC000000050337	O=c2n(CNc1ccccc1)c(=O)c3ccccc23
COc3ccc(CC(=O)Nc2ccc1OCCOc1c2)cc3OC	ZINC000000044441	O=C(Cc1ccccc1)Nc3ccc2OCCOc2c3
O=C4C[C@@H](c2nc(c1ccccc1)cs2)C3(CCCCC3)O4	ZINC000000044447	O=C4CC(c2nc(c1ccccc1)cs2)C3(CCCCC3)O4
Clc4ccc3NC(=O)N[C@@](C#Cc1ccccc1)(C2CC2)c3c4	ZINC000000017077	O=C4Nc1ccccc1C(C#Cc2ccccc2)(C3CC3)N4
Clc3ccc(C(=O)Nc2ccc(c1ccccc1)cc2)c(Cl)c3	ZINC000000060027	O=C(Nc2ccc(c1ccccc1)cc2)c3ccccc3
C[C@@H](Oc1ccccc1)C(=O)NCCc2ccc(S(N)(=O)=O)cc2	ZINC000000031771	O=C(COc1ccccc1)NCCc2ccccc2
CCOC(=O)Cn1nc(C(F)(F)F)cc1C	ZINC000000027744	c1cn[nH]c1
CC(C)(C)c2ccc(C(=O)Nc1ccccc1OC(F)(F)F)s2	ZINC000000112020	O=C(Nc1ccccc1)c2cccs2
COc1ccccc1NC(=S)NCc2csc3ccccc23	ZINC000000069414	S=C(NCc1csc2ccccc12)Nc3ccccc3
COc3ccc2c(C)c(c1ccc(Cl)cc1Cl)c(=O)oc2c3	ZINC000000057996	O=c2oc1ccccc1cc2c3ccccc3
C[n+]3c1ccccc1nc4ccc(N[C@@H]2CCCC[C@@H]2N)cc34	ZINC000004172225	C4CCC(Nc3ccc2nc1ccccc1nc2c3)CC4
C[C@@H]2Nc1ccc(Cl)cc1S(=O)(=O)N2	ZINC000000005921	O=S2(=O)NCNc1ccccc12
Cc3ccc(CSc2nc1n(C)c(=O)[nH]c(=O)c1n2CC=C)cc3	ZINC000000079507	O=c3[nH]c(=O)c2[nH]c(SCc1ccccc1)nc2[nH]3
Cc1ncccc1C(=O)N[C@H]3CCc2ccccc2C3	ZINC000000009341	O=C(NC2CCc1ccccc1C2)c3cccnc3
NCC2CCC(C(=O)Oc1ccc(CCC(O)=O)cc1)CC2	ZINC000000001112	O=C(Oc1ccccc1)C2CCCCC2
CCOC(=O)C2CN(C1CCCCC1)C(=O)C2=Nc3ccc(F)cc3	ZINC000000165278	O=C2N(C1CCCCC1)CCC2=Nc3ccccc3
COc3cc(C(=O)Nc2ccc1[nH]nnc1c2)cc(OC)c3OC	ZINC000000067760	O=C(Nc2ccc1[nH]nnc1c2)c3ccccc3
C[C@@H](Sc2nc1ccccc1[nH]2)C(=O)Nc3c(C)cc(C)cc3C	ZINC000000036103	O=C(CSc2nc1ccccc1[nH]2)Nc3ccccc3
CCN(CC)C[C@@H](O)COc2cc(CN1CCN(C)CC1)ccc2OC	ZINC000019742035	C2CN(Cc1ccccc1)CCN2
FC(F)(F)c3cccc(OC[C@@H]2CNC[C@H](C(=O)NCCc1cnc[nH]1)C2)c3	ZINC000014731604	O=C(NCCc1cnc[nH]1)C3CNCC(COc2ccccc2)C3
CN(Cc2nc(c1ccccn1)no2)C(=O)[C@@H]4CC3(CCNCC3)CN4	ZINC000072162560	O=C(NCc2nc(c1ccccn1)no2)C4CC3(CCNCC3)CN4
O=C(c1ccccc1)n2cc(N(=O)=O)cn2	ZINC000000037183	O=C(c1ccccc1)n2cccn2
CCNc2nc1n(C)c(=O)n(C)c(=O)c1n2CCC(C)C	ZINC000000079564	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
OCC[C@@H]4CN(c2ncnc3sc1CNCCc1c23)CC[N@]4CC5CC5	ZINC000065497749	C1Cc4c(CN1)sc5ncnc(N3CCN(CC2CC2)CC3)c45
COc2cc(C(=O)NCCCn1ccnc1C)ccc2OC3CCN(C)CC3	ZINC000011819610	O=C(NCCCn1ccnc1)c3ccc(OC2CCNCC2)cc3
CCOC(=O)c2nn(c1ccc(F)cc1)c(=O)c3c(N)scc23	ZINC000000054519	O=c2n(c1ccccc1)ncc3cscc23
Nc3ccc(c2cc(=O)c1cc(O)ccc1o2)cc3	ZINC000000004898	O=c2cc(c1ccccc1)oc3ccccc23
Cn2c(CN1CCC(O)CC1)nnc2[C@@H]3CCC[N@@](CCO)C3	ZINC000072436687	C3CCN(Cc2nnc(C1CCCNC1)[nH]2)CC3
C[n+]2ccc(\C=C\c1cccs1)cc2	ZINC000000055356	C(=Cc1cccs1)c2ccncc2
CN(C)\C=C\C(=O)c2nnn(C1CCCCC1)c2NC3CCCCC3	ZINC000000055350	C3CCC(Nc1cnnn1C2CCCCC2)CC3
Cc3ccc(OC(=O)Cn1c(=O)sc2cccc(Cl)c12)cc3C	ZINC000000271401	O=C(Cn1c(=O)sc2ccccc12)Oc3ccccc3
Clc3cccc(COc2cccc(C(=O)Nc1ccccc1)c2)c3	ZINC000000050423	O=C(Nc1ccccc1)c3cccc(OCc2ccccc2)c3
COC(=O)c2ccc(NC(=O)CNc1cc(Cl)ccc1OC)cc2	ZINC000000128718	O=C(CNc1ccccc1)Nc2ccccc2
Nc3ccc(C(=O)Nc2ccc(Oc1ccccc1)cc2)cc3	ZINC000000050425	O=C(Nc2ccc(Oc1ccccc1)cc2)c3ccccc3
CN1CNS(=O)(=O)c2cnccc12	ZINC000000019121	O=S2(=O)NCNc1ccncc12
C[N@]1[C@H]3CC[C@@H]1CC(OC(=O)CCN2CCCC2)C3	ZINC000000198755	O=C(CCN1CCCC1)OC2CC3CCC(C2)N3
CN(C)C3CCN(CCNC(=O)Cn2nc1CCCCCn1c2=O)CC3	ZINC000363348552	O=C(Cn2nc1CCCCCn1c2=O)NCCN3CCCCC3
CN4CCN([C@H]3C[N@@](Cc2ccc(n1cncn1)cc2)C[C@@H]3O)CC4	ZINC000065460748	C4CN(C3CCN(Cc2ccc(n1cncn1)cc2)C3)CCN4
Oc1ccccc1c2nnco2	ZINC000000001423	c2ccc(c1nnco1)cc2
O=C(C[N+]34CC[N+](CC(=O)Nc2ccc1OCCOc1c2)(CC3)CC4)Nc6ccc5OCCOc5c6	ZINC000002597930	O=C(C[N+]34CC[N+](CC(=O)Nc2ccc1OCCOc1c2)(CC3)CC4)Nc6ccc5OCCOc5c6
Cc3nnc(SC(c1ccccc1)c2ccccc2)s3	ZINC000000036121	S(C(c1ccccc1)c2ccccc2)c3nncs3
Clc3ccc(/N=C/c2cc1OCOc1cc2N(=O)=O)cc3Cl	ZINC000000061739	C3Oc2ccc(C=Nc1ccccc1)cc2O3
Cc4ccc3n2CCN[C@H]1CCCc(c12)c3c4	ZINC000000000641	C2CC1NCCn3c1c(C2)c4ccccc34
C[N@](Cc1ccccc1)Cc2cccn2CCN3CCOCC3	ZINC000004715644	C3CN(CCn1cccc1CNCc2ccccc2)CCO3
C[C@H]1CCC3=C(C1)c2c(OC(C)=O)cc(C)cc2OC3(C)C	ZINC000000000644	C1CCC2=C(C1)COc3ccccc23
C[C@H](Cc1cc(C)cc(=O)n1O)CC(C)(C)C	ZINC000000000645	O=c1cccc[nH]1
FC(F)(F)c3nccc(N2CCC(CN1CCCC1=O)CC2)n3	ZINC000000004091	O=C1CCCN1CC3CCN(c2ccncn2)CC3
O=C(Nc1nccs1)[C@H]3CC4c2ccccc2C3c5ccccc45	ZINC000000051060	O=C(Nc1nccs1)C3CC4c2ccccc2C3c5ccccc45
COc3ccc(CN2CC[C@@H](N1CCC(O)CC1)[C@H](O)C2)cc3C	ZINC000039372156	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
CN(C)CCCNC(=O)c1cccnc1NC2CC(C)(C)NC(C)(C)C2	ZINC000012736713	C2CC(Nc1ccccn1)CCN2
Cc2c(Cl)c(=O)oc3c(C)c(OCC(=O)N1CCCCC1)ccc23	ZINC000000196353	O=C(COc2ccc1ccc(=O)oc1c2)N3CCCCC3
C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C	ZINC000001530820	nonring
CN(C)C[C@](C)(O)c2ccc1OCC[N@@](CC=C(C)C)Cc1c2	ZINC000012166249	C2COc1ccccc1CN2
Clc4ccc(n3c(=O)[nH]c2sc1CCCCc1c2c3=O)cc4	ZINC000000052907	O=c3[nH]c2sc1CCCCc1c2c(=O)n3c4ccccc4
CN(C)c2ccc(NC(=O)c1sc(=S)[nH]c1N)cc2	ZINC000000043488	O=C(Nc1ccccc1)c2c[nH]c(=S)s2
Cc2cn(Cc1ccccn1)c(C)n2	ZINC000000008506	C(c1ccccn1)n2ccnc2
CN(C)Cc3cc(CC2(NC1CCN(C)CC1)COC2)no3	ZINC000067897805	C3CC(NC2(Cc1ccon1)COC2)CCN3
Cc2onc(c1ccccc1Cl)c2C(=O)Oc3cc(F)cc(F)c3	ZINC000000256983	O=C(Oc1ccccc1)c2conc2c3ccccc3
COc3ccc(n2c(SC)nc1nc(SC)n(C)c1c2=O)cc3	ZINC000000041972	O=c2n(c1ccccc1)cnc3nc[nH]c23
NS(=O)(=O)c2ccc(CNC(=O)N1CCOCC1)cc2	ZINC000000030346	O=C(NCc1ccccc1)N2CCOCC2
C[C@H](Oc1ccccc1)C(=O)Nc2cc(C)ccc2C	ZINC000000030691	O=C(COc1ccccc1)Nc2ccccc2
C[C@@H]3C[C@@H]2Oc1ccc(Cl)cc1C(=O)N2O3	ZINC000000000463	O=C2N1OCCC1Oc3ccccc23
O=C2CC[C@@H](CCNCc1cccnc1)N2CC4(N3CCOCC3)CCCCC4	ZINC000012218870	O=C2CCC(CCNCc1cccnc1)N2CC4(N3CCOCC3)CCCCC4
COc3ccc(OC)c(S(=O)(=O)NCc2ccc1OCCc1c2)c3	ZINC000000131685	O=S(=O)(NCc2ccc1OCCc1c2)c3ccccc3
CN(C)[C@@H]4CCN(CCN3CC2(CCN(c1ccnc(N)n1)CC2)OC3=O)C4	ZINC000077535432	O=C3OC2(CCN(c1ccncn1)CC2)CN3CCN4CCCC4
CN(C)CCNc3nc1nnnn1c4sc2CN(C)CCc2c34	ZINC000002215016	C1Cc2c(CN1)sc4c2cnc3nnnn34
O=C(COc2ccc(c1ccccc1)cc2)Nc3cccc(N(=O)=O)c3	ZINC000000116642	O=C(COc2ccc(c1ccccc1)cc2)Nc3ccccc3
CC4(C)COC([C@@H](Cc1ccccc1)n3c(=O)c2ccccc2c3=O)=N4	ZINC000000140909	O=c3n(C(Cc1ccccc1)C2=NCCO2)c(=O)c4ccccc34
CN4CCC[C@@H](c3ncc2C[N@@](Cc1ccncc1)CCc2n3)C4	ZINC000019588694	C4CNCC(c3ncc2CN(Cc1ccncc1)CCc2n3)C4
CC(C)NC(=O)C3CCN(C2CCN(C(=O)[C@@H]1CCCC[N@]1C)CC2)CC3	ZINC000011839086	O=C(C1CCCCN1)N3CCC(N2CCCCC2)CC3
CSc2nc(c1ccccc1)nc(SC)c2C(C)=O	ZINC000000034196	c2ccc(c1ncccn1)cc2
CCN2C(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(C(=O)OC)=C2C	ZINC000000067375	O=C2NC=CC(c1ccccc1)N2
NCC[C@@H]4CN(c3nc(NC1CC1)nc2CCNCCc23)CCO4	ZINC000072447436	C4Cc3nc(NC1CC1)nc(N2CCOCC2)c3CCN4
CCC(=O)Oc3cccc(n2c(=O)c1cccc(N(=O)=O)c1c2=O)c3	ZINC000000043002	O=c2n(c1ccccc1)c(=O)c3ccccc23
CN(C)S(=O)(=O)Nc1ccc(Br)cc1	ZINC000000030523	c1ccccc1
Clc3ccc(NC(=O)O/N=C1\CCCC[C@@H]1Cn2ccnc2)cc3	ZINC000000124801	O=C(Nc1ccccc1)ON=C2CCCCC2Cn3ccnc3
O=C([C@@H]1CC2CCN1CC2)N5CCN(C(=O)[C@@H]3CC4CCN3CC4)CC5	ZINC000001610888	O=C(C1CC2CCN1CC2)N5CCN(C(=O)C3CC4CCN3CC4)CC5
Cc2ccc(S(=O)(=O)N/N=C/c1cccc(N(=O)=O)c1)cc2	ZINC000000028349	O=S(=O)(NN=Cc1ccccc1)c2ccccc2
Nc1nnnn1/N=C/c2ccccc2C(F)(F)F	ZINC000000050986	C(=Nn1cnnn1)c2ccccc2
COc3ccc(OC(=O)Nc2csc(Cc1ccsc1)n2)cc3	ZINC000000172354	O=C(Nc2csc(Cc1ccsc1)n2)Oc3ccccc3
Clc4ccc(C(=O)CN2C(=O)C1(OCCO1)c3ccccc23)cc4	ZINC000000062112	O=C(CN2C(=O)C1(OCCO1)c3ccccc23)c4ccccc4
CCOc2ccc(C(=O)Nc1cc(OC)ccc1OC)cc2N(=O)=O	ZINC000000181524	O=C(Nc1ccccc1)c2ccccc2
CCN1CCCN(CC)CC[N@](CC)CCCN(CC)CC1	ZINC000038428364	C1CNCCNCCCNCCNC1
Cc4cc(N2CCN(CC1=CCCOC1)CC2)cc([C@@H]3CCCN3)n4	ZINC000019697962	C4CNC(c3cc(N2CCN(CC1=CCCOC1)CC2)ccn3)C4
C[N@@](C[C@@H]1COCCO1)Cc2ccccc2c3nc(CN)cc(=O)[nH]3	ZINC000023541980	O=c3ccnc(c1ccccc1CNCC2COCCO2)[nH]3
O=C(Nc1ccccc1C2=NCCN2)Nc3ccccc3C4=NCCN4	ZINC000006567865	O=C(Nc1ccccc1C2=NCCN2)Nc3ccccc3C4=NCCN4
CC[C@@H](C)NC(=O)C2c1ccccc1Oc3ccccc23	ZINC000000030234	C2c1ccccc1Oc3ccccc23
CC(C)C[N@]3C[C@@H](COc1ccc(C)nc1)C[C@@H](C(=O)NCCCN2CCOCC2)C3	ZINC000014534428	O=C(NCCCN1CCOCC1)C3CNCC(COc2cccnc2)C3
CC2=[N+](C)c1cc(C(F)(F)F)ccc1C2(C)C	ZINC000000086924	C1C=Nc2ccccc12
CCOC(=O)c1sc(C)c(C)c1NC(=O)c2ccccc2	ZINC000000050859	O=C(Nc1ccsc1)c2ccccc2
O=C(CCCN1CCCCCC1)N2CCC[C@@H]2c4nnc3CCNCCn34	ZINC000019710630	O=C(CCCN1CCCCCC1)N2CCCC2c4nnc3CCNCCn34
CC(C)=CCCc3cc(C(=O)NC1=NCCS1)c2ccccc2n3	ZINC000000034203	O=C(NC1=NCCS1)c2ccnc3ccccc23
O=S(=O)(CC[n+]1ccccc1)CCS(=O)(=O)CC[n+]2ccccc2	ZINC000004831627	O=S(=O)(CC[n+]1ccccc1)CCS(=O)(=O)CC[n+]2ccccc2
CS(=O)(=O)c3ccc2nc(NC(=O)Oc1ccccc1)sc2c3	ZINC000000145456	O=C(Nc2nc1ccccc1s2)Oc3ccccc3
C[C@@H](C(=O)NCCn1cc(N(=O)=O)cn1)n2ncc(Cl)c2C	ZINC000000375139	O=C(Cn1cccn1)NCCn2cccn2
CC(=O)N4CCCN(Cc1ccccc1OC[C@@H](O)C[N@]3CCc2ccccc2C3)CC4	ZINC000012716153	C4CNCCN(Cc1ccccc1OCCCN3CCc2ccccc2C3)C4
CC(C)(C)CC(=O)NCc1ccc(S(N)(=O)=O)cc1	ZINC000000030836	c1ccccc1
Oc1c(Br)cc(Cl)c2cccnc12	ZINC000000002243	c2ccc1ncccc1c2
C[C@@H]3CN(CC2CCN(Cc1cn(C)c(=O)n(C)c1=O)CC2)C[C@@H](C)O3	ZINC000092587471	O=c3[nH]cc(CN2CCC(CN1CCOCC1)CC2)c(=O)[nH]3
CC(=O)Nc3nnc(Cn1cnc2n(C)c(=O)n(C)c(=O)c12)s3	ZINC000000053087	O=c3[nH]c(=O)c2n(Cc1nncs1)cnc2[nH]3
Cc3ccc(C(=O)c2cc1OCCOc1cc2Br)cc3	ZINC000000042260	O=C(c1ccccc1)c3ccc2OCCOc2c3
C[C@@H]2CN(C(C)(C)C#CC#CC(C)(C)[N@@]1CC[C@H](O)[C@H](C)C1)CC[C@@H]2O	ZINC000004753524	C2CCN(CC#CC#CCN1CCCCC1)CC2
CCN(Cc1ccccc1)C(=O)CCN2[C@@H](C)CC(C)(C)NC2=S	ZINC000000211993	O=C(CCN1CCCNC1=S)NCc2ccccc2
CCOC(=O)c1ccccc1N2C(C)=CC(C)(C)NC2=S	ZINC000000034331	S=C1NCC=CN1c2ccccc2
Cc1ccccc1N3CCN(C(=O)c2ccccc2O)CC3	ZINC000000034441	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
NC(=O)c2cc(Oc1ccc(Br)cc1)nc3ccccc23	ZINC000000197770	O(c1ccccc1)c3ccc2ccccc2n3
Nc2ccn(c1ccc(Cl)cc1)c(=O)c2	ZINC000000025451	O=c1ccccn1c2ccccc2
CC(=O)Oc2c(CC=C)c(=O)n(c1ccccc1)c3ncccc23	ZINC000000024928	O=c2ccc1cccnc1n2c3ccccc3
COC(=O)C(N=Nc2ccc(n1nc(C)cc1C)cc2)C(=O)OC	ZINC000000110220	c2ccc(n1cccn1)cc2
CN1CCC4(CC1)NC(=O)N(CN3CCN(CCOc2ccccc2)CC3)C4=O	ZINC000022787278	O=C2NC1(CCNCC1)C(=O)N2CN4CCN(CCOc3ccccc3)CC4
Cc2ccc(NC(=O)N1CCOCC1)cc2NC(=O)N3CCOCC3	ZINC000000039330	O=C(Nc2cccc(NC(=O)N1CCOCC1)c2)N3CCOCC3
Clc4cccc(Nc2nc1nonc1n3nnnc23)c4	ZINC000000068560	N(c1ccccc1)c3nc2nonc2n4nnnc34
CC(C)(C)c3ccc(C(=O)Nc2nnc(C1CCCCC1)s2)cc3	ZINC000000340140	O=C(Nc2nnc(C1CCCCC1)s2)c3ccccc3
CC3(C)Oc1ccncc1C(n2ccccc2=O)=C3	ZINC000000010479	O=c1ccccn1C2=CCOc3ccncc23
COC(=O)CSc1cc(C(F)(F)F)nc2cc(C(C)(C)C)nn12	ZINC000000169714	c2cnc1ccnn1c2
CCOc3ccc2N(C(=O)NC1CCCCC1)C(C)(C)C[C@H](C)c2c3	ZINC000000169715	O=C(NC1CCCCC1)N2CCCc3ccccc23
NCCn3nc([C@@H]2CC[N@@](Cc1ccccc1)C2)c4nccnc34	ZINC000019371781	C2CN(Cc1ccccc1)CC2c3n[nH]c4nccnc34
C[N@@](C/C=C\CN)C[C@H]3O[C@@H](n1cnc2c(N)ncnc12)C[C@@H]3O	ZINC000027558564	C3COC(n1cnc2cncnc12)C3
Cc3ccc(Nc1nc(C)nc2sc(C)cc12)c(Br)c3	ZINC000000224138	N(c1ccccc1)c2ncnc3sccc23
Fc3cccc(C(=O)Nc2ccc(N1CCOCC1)cc2)c3	ZINC000000038036	O=C(Nc2ccc(N1CCOCC1)cc2)c3ccccc3
FC(F)(F)c4ccc(c3nnc(c2ccc1nsnc1c2)o3)cc4	ZINC000000156669	c4ccc(c3nnc(c2ccc1nsnc1c2)o3)cc4
C2CCN=C(NN=CC=NNC1=NCCCCN1)NC2	ZINC000008665439	C2CCN=C(NN=CC=NNC1=NCCCCN1)NC2
Cc2nc1ccccc1n2c3ccc(S(N)(=O)=O)cc3	ZINC000000033877	c3ccc(n1cnc2ccccc12)cc3
Fc3ccc(NC(=O)c2ccc(c1ccc(Cl)cc1)s2)c(F)c3	ZINC000000171676	O=C(Nc1ccccc1)c3ccc(c2ccccc2)s3
CCCc2cc(=O)oc3cc(OCc1cccc(F)c1)c(Cl)cc23	ZINC000000317557	O=c3ccc2ccc(OCc1ccccc1)cc2o3
Brc1ccccc1C(=O)Oc3cc(=O)n2CCCCc2n3	ZINC000000344189	O=C(Oc2cc(=O)n1CCCCc1n2)c3ccccc3
COc4ccc(C[N@]3CCc2nc([C@@H]1CCNC1)ncc2C3)c(OC)c4	ZINC000019552472	C4CC(c3ncc2CN(Cc1ccccc1)CCc2n3)CN4
COC(=O)c2ccc([C@@H]1N(C[C@@H](C)O)C(=O)C(O)=C1C(C)=O)cc2	ZINC000000082157	O=C2NC(c1ccccc1)C=C2
Ic2c(c1ccccc1)noc2c3ccccc3	ZINC000000288972	c3ccc(c2cc(c1ccccc1)on2)cc3
Nc2ncnc3n([C@H]1O[C@H](CO)C=C1)cnc23	ZINC000000033893	C3OC(n1cnc2cncnc12)C=C3
O=c1cnn4c(n1)sc3c(=O)n(c2ccccc2)c(=O)c34	ZINC000000113452	O=c1cnn4c(n1)sc3c(=O)n(c2ccccc2)c(=O)c34
O[C@@H](COc1ccccc1CNCc2cccnc2)CN3CCSCC3	ZINC000012373728	C(COc1ccccc1CNCc2cccnc2)CN3CCSCC3
CN(C)CCCNc1n[nH]c(NCCCN(C)C)c2ncnc12	ZINC000001692109	c2nc1cn[nH]cc1n2
Cc1ccccc1Oc2cc(C#N)c(C#N)cc2Oc3ccccc3C	ZINC000000045146	O(c1ccccc1)c2ccccc2Oc3ccccc3
N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O	ZINC000000057505	c2ccc1[nH]ccc1c2
CN(Cc1ccccc1)C(=O)[C@@H]2CCCc3nc[nH]c23	ZINC000000027173	O=C(NCc1ccccc1)C2CCCc3nc[nH]c23
Cc1cc(Cl)ccc1NC(=O)[C@H]2CCCN2C(=O)c3cccs3	ZINC000000241192	O=C(Nc1ccccc1)C2CCCN2C(=O)c3cccs3
CC4CCN(Cc3cc2CN(C(=O)c1cn(CCCN)nn1)CCn2n3)CC4	ZINC000072424859	O=C(N3CCn2nc(CN1CCCCC1)cc2C3)c4c[nH]nn4
O=C(Nc1cccnc1)[C@H]2CCCN2C(=O)OCc3ccccc3	ZINC000000005731	O=C(Nc1cccnc1)C2CCCN2C(=O)OCc3ccccc3
CC(=O)Oc1cccc(O)c1	ZINC000000002029	c1ccccc1
CC(C)NC(=O)c3ccc2c(=O)n(c1ccc(C)c(C)c1)c(=O)c2c3	ZINC000000049177	O=c2n(c1ccccc1)c(=O)c3ccccc23
Nc3nnc(CCCNC[C@]2(O)CCC[N@]1CCCC[C@@H]12)s3	ZINC000063856485	C3CCN2CCCC(CNCCCc1nncs1)C2C3
O=N(=O)c2c(NCCN1CCCC1)ncnc2NCCN3CCCC3	ZINC000004656438	C3CCN(CCNc2cc(NCCN1CCCC1)ncn2)C3
O=C(CSc2nc1ccccc1[nH]2)NCc3ccco3	ZINC000000036116	O=C(CSc2nc1ccccc1[nH]2)NCc3ccco3
O=N(=O)c3ccc(Cn1c(=O)sc2ccccc12)cc3	ZINC000000041163	O=c2sc1ccccc1n2Cc3ccccc3
CCN(CC)C[C@@H]1CCCN1C(=O)[C@@H]2CCCCC[N@]2C	ZINC000019147686	O=C(C1CCCCCN1)N2CCCC2
Brc2ccc(CC(=O)Nc1ccccn1)cc2	ZINC000000030766	O=C(Cc1ccccc1)Nc2ccccn2
CN(C)CCC4CCN(C(=O)CN3CCC(c2cc(=O)n1CCCCCc1n2)CC3)CC4	ZINC000019582167	O=C(CN3CCC(c2cc(=O)n1CCCCCc1n2)CC3)N4CCCCC4
CC(=O)OC1CC(C)(C)N(C(C)=O)C(C)(C)C1	ZINC000000027758	C1CCNCC1
COc1ccccc1NC(=S)NNC(=S)N[C@@H]2C[C@H]3C[C@@H]2C=C3	ZINC000000137166	S=C(NNC(=S)Nc1ccccc1)NC2CC3CC2C=C3
COCCN1CC[C@@]3(CCC1=O)CN(c2cc(C)nc(N)n2)CC[N@]3C	ZINC000095367404	O=C1CCC3(CCN1)CN(c2ccncn2)CCN3
CCN3CCN(CCN2CC1(CCN(C(CO)CO)CC1)OC2=O)CC3	ZINC000072453561	O=C2OC1(CCNCC1)CN2CCN3CCNCC3
CC(C)OC(=O)c2cccc(NC(=O)CSc1nncn1C)c2	ZINC000000088817	O=C(CSc1nnc[nH]1)Nc2ccccc2
CCOC(=O)c1nsc(Cl)c1Cl	ZINC000000027756	c1cnsc1
NS(=O)(=O)c2ccc(CCNC(=O)Cc1cccs1)cc2	ZINC000000031727	O=C(Cc1cccs1)NCCc2ccccc2
Cn1ccnc1CN4[C@@H]3C[N@@](Cc2ccccc2O)C[C@@H]3OCC4=O	ZINC000067897340	O=C3COC2CN(Cc1ccccc1)CC2N3Cc4ncc[nH]4
CCCC(=O)Nc2[nH]nc3cnc(c1ccccc1)cc23	ZINC000000009357	c3ccc(c2cc1c[nH]nc1cn2)cc3
Clc3ccc(CCNC(=O)[C@@H]1CCC(=O)N1C2CCCCC2)cc3	ZINC000000219575	O=C2CCC(C(=O)NCCc1ccccc1)N2C3CCCCC3
CCOC(=O)c2[nH]c(C)c(CNc1cc(OC)ccc1OC)c2C	ZINC000000033658	C(Nc1ccccc1)c2cc[nH]c2
Fc3ccc(/C(=N\OC(=O)\C=C\c1ccccc1)c2cccnc2)cc3	ZINC000000189962	O=C(ON=C(c1ccccc1)c2cccnc2)C=Cc3ccccc3
CN4CCC([N@]1CC[C@@H]3[C@H]1C(=O)NC[C@H](CCC(=O)Nc2ccccc2)N3C)CC4	ZINC000022923142	O=C(CCC3CNC(=O)C1C(CCN1C2CCNCC2)N3)Nc4ccccc4
CN(C)CCNC(=O)[C@@H]4C[C@H](CN1CCOCC1)C[N@](Cc3ccc2ccccc2c3)C4	ZINC000014748855	C4CC(CN1CCOCC1)CN(Cc3ccc2ccccc2c3)C4
CN(C)CCCNC(=S)N/N=C2\C1CN4CC[N@](C1)CC2(Cc3ccccc3)C4	ZINC000020215520	N=C2C1CN4CCN(C1)CC2(Cc3ccccc3)C4
NCCc4nc(N2CCC(N1CCCCC1)(C(N)=O)CC2)c3ccccc3n4	ZINC000065489048	C4CCN(C3CCN(c1ncnc2ccccc12)CC3)CC4
Cc4ccc(Nc2nc1nonc1n3c(CC(N)=O)nnc23)cc4	ZINC000000054184	N(c1ccccc1)c3nc2nonc2n4cnnc34
COc2ccc(c1nc(N)nc(N)n1)cc2OC	ZINC000000011431	c2ccc(c1ncncn1)cc2
C[C@H](N1C(=O)CCC1=O)C(=O)Nc3nc(c2ccccc2)cs3	ZINC000000051102	O=C(CN1C(=O)CCC1=O)Nc3nc(c2ccccc2)cs3
CN[C@@H](Cc1ccccc1)C(=O)N2CCC[C@@H]2C(=O)NCC3CCC(N)CC3	ZINC000006452443	O=C(CCc1ccccc1)N2CCCC2C(=O)NCC3CCCCC3
CCOC(=O)c2ccc(NN=c1c(=O)[nH]c(=S)[nH]c1=O)cc2	ZINC000000059126	O=c1[nH]c(=S)[nH]c(=O)c1=NNc2ccccc2
CCOC(=O)C2CCN(C(=O)COc1ccc(C(C)(C)C)cc1)CC2	ZINC000000259676	O=C(COc1ccccc1)N2CCCCC2
COc2ccc(c1nc(N)nc(N)n1)cc2	ZINC000000004396	c2ccc(c1ncncn1)cc2
CC4CCN(C(=O)C[N@@]3CCc2nnc([C@@H]1CCCN1)n2CC3)CC4	ZINC000019706304	O=C(CN3CCc2nnc(C1CCCN1)n2CC3)N4CCCCC4
CN3CCC(N2CC[N@@](Cc1ccc(C#CC(C)(C)O)s1)C[C@@H]2CCO)CC3	ZINC000023145117	C3CC(N2CCN(Cc1cccs1)CC2)CCN3
CN(C)Nc2ncnc(N(C)C1CCN(C)CC1)c2N	ZINC000040760119	C2CC(Nc1ccncn1)CCN2
CCN2CCN(c1ncnc(NNC(C)(C)C)c1N)CC2	ZINC000040726763	C2CN(c1ccncn1)CCN2
CN4CCN(c3nccc(CN[C@@H]1CCC(=O)N[C@H]1c2cccc(F)c2)n3)CC4	ZINC000012182280	O=C4CCC(NCc2ccnc(N1CCNCC1)n2)C(c3ccccc3)N4
CC(C)(C)[C@@H](O)\C=C\c2ccc1OCOc1c2	ZINC000000000724	C2Oc1ccccc1O2
COc5cccc([C@@H]3C1=C(COC1=O)Oc4cc2OCOc2cc34)c5	ZINC000000044601	O=C1OCC5=C1C(c2ccccc2)c4cc3OCOc3cc4O5
Nc5ccc(Cc4ccc(N3C(=O)[C@H]2[C@H]1C[C@H](C=C1)[C@H]2C3=O)cc4)cc5	ZINC000000085319	O=C3C2C1CC(C=C1)C2C(=O)N3c5ccc(Cc4ccccc4)cc5
COc3ccc(CN2CCC(n1cc(C(=O)NCCN(C)C)nn1)CC2)c(OC)c3C	ZINC000012158040	C2CN(Cc1ccccc1)CCC2n3ccnn3
Cc3nc2ccc(C(=O)N(CC=C)c1ccccc1)cc2nc3C	ZINC000000034202	O=C(Nc1ccccc1)c3ccc2nccnc2c3
O=C2C=CC[C@H]1[C@H]3CCC[N@]4CCC[C@H](CN12)[C@H]34	ZINC000000008712	O=C2C=CCC1C3CCCN4CCCC(CN12)C34
Brc1ccccc1OCC(=O)NCCc2ccccc2	ZINC000000037979	O=C(COc1ccccc1)NCCc2ccccc2
COc2ccc(CC(=O)c1c(O)cc(O)cc1O)cc2	ZINC000000008630	O=C(Cc1ccccc1)c2ccccc2
FC(F)(F)c2ccc(\C=N\n1cnnc1)cc2	ZINC000000028591	C(=Nn1cnnc1)c2ccccc2
Cc3c(O)c(C)c2O[C@@H](c1ccc(O)cc1)CC(=O)c2c3O	ZINC000000001419	O=C2CC(c1ccccc1)Oc3ccccc23
CC(=O)Nc1c(=O)[nH]c2cssc12	ZINC000000001259	O=c2cc1sscc1[nH]2
CNCCCNC[C@H]3O[C@@H](n1cnc2c(N)ncnc12)[C@H](O)[C@@H]3O	ZINC000049089131	C3COC(n1cnc2cncnc12)C3
Clc2ccc(OCC(=O)NC[C@@H]1CCCO1)c(Cl)c2	ZINC000000037574	O=C(COc1ccccc1)NCC2CCCO2
COc3ccc(C(=O)N(C1CCCCC1)C2CCCCC2)cc3OC	ZINC000000293743	O=C(N(C1CCCCC1)C2CCCCC2)c3ccccc3
Oc3ccc2oc(c1ccc(O)c(O)c1)c(O)c(=O)c2c3	ZINC000000008662	O=c2cc(c1ccccc1)oc3ccccc23
C(Nc2ccc1nnnn1n2)n3nnc4ccccc34	ZINC000000056295	C(Nc2ccc1nnnn1n2)n3nnc4ccccc34
COc4ccc3[nH]cc([C@H](O)CN2CCC(O)(Cn1ccnc1C)CC2)c3c4	ZINC000019287931	C3CN(CCc1c[nH]c2ccccc12)CCC3Cn4ccnc4
CC(=O)O[C@H](c1ccc(Cl)c(Cl)c1)C(Cl)(Cl)Cl	ZINC000000000072	c1ccccc1
C[C@@H](C(=O)Nc1nn[nH]n1)n3c(=O)c2ccccc2c3=O	ZINC000000040584	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3nn[nH]n3
CN3CCN(c2ccc(N)c(N1CCN(C)CC1)c2)CC3	ZINC000000783310	C3CN(c2cccc(N1CCNCC1)c2)CCN3
CC2(C)NC(=O)[C@@H](\C=C\c1ccccc1)O2	ZINC000000000479	O=C1NCOC1C=Cc2ccccc2
C[C@H]2[C@H]3Cc1ccc(O)cc1[C@]2(C)CC[N@]3C	ZINC000000000473	C3CC1CC(Cc2ccccc12)N3
CC3(C)Oc1cc(N(=O)=O)sc1[C@@H](N2CCCCC2=O)[C@@H]3O	ZINC000000015200	O=C1CCCCN1C2CCOc3ccsc23
CCC[C@@H](C)NS(=O)(=O)c1ccc(OC)cc1	ZINC000000030359	c1ccccc1
CCN(Cc1ccccc1)C(=O)c2ccc(OC)cc2	ZINC000000029237	O=C(NCc1ccccc1)c2ccccc2
CCN4CCN(C(=O)c3ccc(N2CCC(N[C@@H](C)Cc1ccccn1)CC2)cc3)CC4	ZINC000012154351	O=C(N1CCNCC1)c4ccc(N3CCC(NCCc2ccccn2)CC3)cc4
C[C@@H](Sc1ccccc1Cl)C(=O)NCC2CC2	ZINC000000007159	O=C(CSc1ccccc1)NCC2CC2
COc2ccc(N(C)C(=O)CCN1[C@@H](C)CC(C)(C)NC1=S)cc2	ZINC000000212520	O=C(CCN1CCCNC1=S)Nc2ccccc2
Cc1ccccc1CN4CCC(N3CCC(C(=O)N2CCCN(C=O)CC2)CC3)CC4	ZINC000012455672	O=C(C3CCN(C2CCN(Cc1ccccc1)CC2)CC3)N4CCCNCC4
Cc2cc(C)nc(SCCS(=O)(=O)Cc1ccccc1)n2	ZINC000000038518	O=S(=O)(CCSc1ncccn1)Cc2ccccc2
C[N@]4CC[C@@H](CNc3ccc(C(=O)N2CCC(N1CCOCC1)CC2)cn3)C4	ZINC000067743135	O=C(N2CCC(N1CCOCC1)CC2)c4ccc(NCC3CCNC3)nc4
CC(C)N4CCC(N[C@@H]2CCCc3nc(N1CCC(CO)CC1)ncc23)CC4	ZINC000012432157	C4CCN(c3ncc2C(NC1CCNCC1)CCCc2n3)CC4
CN4CCC[C@@H]3C[N@@](C[C@H](O)Cn2c(c1ccccc1)noc2=O)CC[C@@H]34	ZINC000158830287	O=c2onc(c1ccccc1)n2CCCN4CCC3NCCCC3C4
C(NCc2ccc(n1ccnc1)cc2)[C@@H]4COc3ccccc3O4	ZINC000008706495	C(NCc2ccc(n1ccnc1)cc2)C4COc3ccccc3O4
Cn4ncc(N3CCO[C@@H](CCNC2CCC1(CCNCC1)CC2)C3)cc4=O	ZINC000067434641	O=c4cc(N3CCOC(CCNC2CCC1(CCNCC1)CC2)C3)cn[nH]4
CN2CCC([N@@](C)CC(/C)=C/c1ccccc1)CC2	ZINC000004987606	C2CC(NCC=Cc1ccccc1)CCN2
CCOC(=O)c1cncn1[C@H]2CCCc3ccccc23	ZINC000000000270	C3CC(n1ccnc1)c2ccccc2C3
CC(=O)Nc3cccc(NC(=O)c1c(C)onc1c2ccccc2)c3	ZINC000000081308	O=C(Nc1ccccc1)c2conc2c3ccccc3
Cc4ccc(CN1CCCn2c1nc3n(C)c(=O)[nH]c(=O)c23)cc4	ZINC000000044024	O=c4[nH]c(=O)c3n2CCCN(Cc1ccccc1)c2nc3[nH]4
Brc3ccc2[nH]c(=O)cc(C(=O)NCc1ccco1)c2c3	ZINC000000263730	O=C(NCc1ccco1)c2cc(=O)[nH]c3ccccc23
C[C@H]4C[C@@H](N(C(=O)c1cccs1)c2ccccc2)c3ccccc3N4	ZINC000000081301	O=C(N(C1CCNc2ccccc12)c3ccccc3)c4cccs4
CC(C)N4CCC([N@]3CC[C@@H](C2CCN(c1ncccn1)CC2)C3)CC4	ZINC000012301305	C4CC(N3CCC(C2CCN(c1ncccn1)CC2)C3)CCN4
CN(C)CCN4C(=O)C[C@@](CC(=O)N2CCN(Cc1ccccc1)CC2)(c3cccc(F)c3)C4=O	ZINC000012037197	O=C4CC(CC(=O)N2CCN(Cc1ccccc1)CC2)(c3ccccc3)C(=O)N4
Cc3nn(c1ccccc1)c4OC(N)=C(C#N)[C@H](c2ccoc2)c34	ZINC000000031808	O3C=CC(c1ccoc1)c4cnn(c2ccccc2)c34
CC(C)NC(=O)Cc1ccc(Br)cc1	ZINC000000030532	c1ccccc1
Cc2cc(C)c(C#N)c(SCc1ccccc1F)n2	ZINC000000031801	C(Sc1ccccn1)c2ccccc2
FC(F)(F)c1ccccc1NC(=O)c2cccs2	ZINC000000029346	O=C(Nc1ccccc1)c2cccs2
CN(C(=O)c1cc(C(C)(C)C)nn1C)c2nnc(C(F)(F)F)s2	ZINC000000155751	O=C(Nc1nncs1)c2ccn[nH]2
CN(C)CCn2c(C)c(C)c3c(NCc1ccco1)ncnc23	ZINC000006669863	C(Nc1ncnc2[nH]ccc12)c3ccco3
COc4ccc(CC(=O)n2c1ccccc1sc3ccccc23)cc4	ZINC000000117831	O=C(Cc1ccccc1)n3c2ccccc2sc4ccccc34
CCOc1ccccc1OCC(=O)Nc3nc2ccc(C)cc2s3	ZINC000000145238	O=C(COc1ccccc1)Nc3nc2ccccc2s3
CN4CCC(N3CC[N@@](Cc1cccc2nonc12)C[C@@H]3CCO)CC4	ZINC000020782008	C4CC(N3CCN(Cc1cccc2nonc12)CC3)CCN4
CC(=O)Oc2ccc(C(=O)Nc1cc(Cl)ccc1C)cc2	ZINC000000030314	O=C(Nc1ccccc1)c2ccccc2
CC3(C)OC(=O)Nc2ccc(c1cccc(F)c1)cc23	ZINC000000008885	O=C3Nc2ccc(c1ccccc1)cc2CO3
Nc3ccc(c2cc(=O)c1c(N)cccc1o2)cc3	ZINC000000006739	O=c2cc(c1ccccc1)oc3ccccc23
COc2cc(C(=O)N(C)Cc1ccccc1)cc(OC)c2OC	ZINC000000030226	O=C(NCc1ccccc1)c2ccccc2
CCc2ccc(NS(=O)(=O)c1ccccc1)cc2	ZINC000000029182	O=S(=O)(Nc1ccccc1)c2ccccc2
Nc1nnnn1/N=C/c3ccc(N2CCOCC2)cc3	ZINC000000074346	C3CN(c2ccc(C=Nn1cnnn1)cc2)CCO3
C[N+](C)(C)CCCCC[N+](C)(C)C1CCCCC1	ZINC000003159017	C1CCCCC1
COc1ccccc1Oc3ccc(S(=O)(=O)N2CCOCC2)cc3	ZINC000000074619	O=S(=O)(N1CCOCC1)c3ccc(Oc2ccccc2)cc3
CCN(CC)CCOC(=O)c1ccc(NC(=O)CN(CC)CC)cc1	ZINC000004536994	c1ccccc1
FC(F)(F)Oc3ccc(N[C@H]1OC(=O)c2ccccc12)cc3	ZINC000000032916	O=C2OC(Nc1ccccc1)c3ccccc23
Cc2ccc1nsnc1c2S(=O)(=O)NCc3cccnc3	ZINC000000032910	O=S(=O)(NCc1cccnc1)c2cccc3nsnc23
NC(=S)c1ncn2ccc(=S)[nH]c12	ZINC000000023660	S=c2ccn1cncc1[nH]2
CCOC(=O)c3ccc(/N=C/c1c(OCC)ccc2ccccc12)cc3	ZINC000000131335	C(=Nc1ccccc1)c2cccc3ccccc23
C[C@@H](OC[C@@H](O)C[N@@](C)C1CCN(C)CC1)c2ccc(Cl)cc2	ZINC000006083724	C(CNC1CCNCC1)COCc2ccccc2
CCOC(=O)c2sc(=S)n(Cc1ccccc1)c2N	ZINC000000032685	S=c1sccn1Cc2ccccc2
Cn1cnnc1SCCn3c(=O)[nH]c2ccccc2c3=O	ZINC000000040962	O=c2[nH]c1ccccc1c(=O)n2CCSc3nnc[nH]3
COC(=O)c/2c(C)n(c1ccc(F)cc1)c(=O)c\2=C/c3cccs3	ZINC000000118959	O=c2n(c1ccccc1)ccc2=Cc3cccs3
Cc2ccc(OC[C@H](O)c1cccnc1)c(C)c2	ZINC000000024864	C(Cc1cccnc1)Oc2ccccc2
CC(=O)OC[C@H]1OC=C[C@@H](OC(C)=O)[C@@H]1OC(C)=O	ZINC000000057063	C1COC=CC1
COC(=O)C1=C(C)NC(=O)N[C@@H]1c3cc(Cl)cc2COCOc23	ZINC000000032688	O=C3NC=CC(c2cccc1COCOc12)N3
CCOC(=O)c4ccc(n1c(=O)c3cccc2cccc(c1=O)c23)cc4	ZINC000000049414	O=c2n(c1ccccc1)c(=O)c4cccc3cccc2c34
COc2cc(Cl)c(S(=O)(=O)NCc1ccccn1)cc2Cl	ZINC000000308918	O=S(=O)(NCc1ccccn1)c2ccccc2
O=C(CCN(C2CCN(Cc1ccccc1)CC2)S(=O)(=O)c3ccccc3)N4CCNCC4	ZINC000015862692	O=C(CCN(C2CCN(Cc1ccccc1)CC2)S(=O)(=O)c3ccccc3)N4CCNCC4
Cc2ccc(NC(=O)CSc1nncn1C)cc2	ZINC000000031482	O=C(CSc1nnc[nH]1)Nc2ccccc2
CC(C)N3CCC([N@]2CCC[C@@H](C(=O)NCCn1cccn1)C2)CC3	ZINC000012573366	O=C(NCCn1cccn1)C3CCCN(C2CCNCC2)C3
COc2ccc1[nH]cc([C@H](C)CNC(C)=O)c1c2	ZINC000000024663	c2ccc1[nH]ccc1c2
Cc1ncc(N(=O)=O)n1CCOC(c2ccccc2)c3ccccc3	ZINC000000024466	C(Cn1ccnc1)OC(c2ccccc2)c3ccccc3
Nc4nc3N[C@H](c1ccccc1)C[C@H](c2c(F)cccc2Cl)n3n4	ZINC000000205917	C3C(c1ccccc1)Nc2ncnn2C3c4ccccc4
COC(=O)c2ccc(NC(=O)c1ccc(N(=O)=O)cc1Cl)cc2	ZINC000000047733	O=C(Nc1ccccc1)c2ccccc2
Oc3ccc(Nc2c(Cl)c(=O)c1ccncc1c2=O)cc3	ZINC000000023594	O=c2cc(Nc1ccccc1)c(=O)c3cnccc23
FC(F)(F)[C@@]3(C#CC1CC1)OCC(=O)Nc2ccc(Cl)cc23	ZINC000000023592	O=C3COC(C#CC1CC1)c2ccccc2N3
Cc1cc(=O)oc2cc(NC(=O)[C@@H](N)CCCNC(N)=N)ccc12	ZINC000002522647	O=c2ccc1ccccc1o2
CC4(C)Cc1c(ccc2ccccc12)C(=CC(=O)N3CCCCCC3)N4	ZINC000000210006	O=C(C=C1NCCc2c1ccc3ccccc23)N4CCCCCC4
CCOc2ccc(C(=O)N[C@@H](C)c1ccccc1)cc2	ZINC000000029960	O=C(NCc1ccccc1)c2ccccc2
O=C2CNC(=O)[C@@H](c1cccs1)N2	ZINC000000004710	O=C2CNC(=O)C(c1cccs1)N2
CN(C[C@@H]2CCC[N@@](CCc1ccc(Cl)cc1)C2)C(=O)CN3CC(=O)[O+]=N3	ZINC000014966089	O=C(CN1CC(=O)[O+]=N1)NCC3CCCN(CCc2ccccc2)C3
Clc3ccc(\C=N\NS(=O)(=O)c2ccc1ccccc1c2)cc3	ZINC000000248149	O=S(=O)(NN=Cc1ccccc1)c3ccc2ccccc2c3
COC(=O)c2cnn(c1ccccc1)c2\C=N\OC(=O)c3ccccc3	ZINC000000124131	O=C(ON=Cc1ccnn1c2ccccc2)c3ccccc3
COc2ccc(OC)c(c1csc(N)n1)c2	ZINC000000038022	c2ccc(c1cscn1)cc2
CCCc2nnc(NC(=O)CC(=O)NCc1ccccc1)s2	ZINC000000042070	O=C(CC(=O)Nc1nncs1)NCc2ccccc2
CCN=C(NCCOCCNC(SC)=NCC)SC	ZINC000004514967	nonring
CC(C)NC(=S)N/N=C/c2ccc(c1ccc(N(=O)=O)cc1)o2	ZINC000000072607	c2ccc(c1ccco1)cc2
CCOC(=O)N3CCN(c2nc(c1ccc(OC)cc1)cs2)CC3	ZINC000000039253	C3CN(c2nc(c1ccccc1)cs2)CCN3
O=C(Nc1ccccc1C#N)c3cc(c2ccccc2)nc4ccccc34	ZINC000000245072	O=C(Nc1ccccc1)c3cc(c2ccccc2)nc4ccccc34
C4COc3cc(NCc2ccc(OCc1ccccc1)cc2)ccc3O4	ZINC000000360040	C4COc3cc(NCc2ccc(OCc1ccccc1)cc2)ccc3O4
C[N+](=O)Cc1ccc(C(F)(F)F)cc1	ZINC000000084687	c1ccccc1
COC(=O)[C@@H]1CS[C@H](C(=O)OC)N1C(=O)Nc2ccccc2	ZINC000000041502	O=C(Nc1ccccc1)N2CCSC2
Cc1cccnc1N4CCN(C(=O)c3cn(C[C@@H]2CCCNC2)nn3)CC4	ZINC000065398806	O=C(N2CCN(c1ccccn1)CC2)c4cn(CC3CCCNC3)nn4
O[C@H](C#C)c4ccc(c2nn(Cc1ccccc1)c3ccccc23)o4	ZINC000000017767	C(c1ccccc1)n3nc(c2ccco2)c4ccccc34
CC(=O)C(=Cc1ccc(O)cc1)C(C)=O	ZINC000000014894	c1ccccc1
COc1ccc(C=C(C(C)=O)C(C)=O)cc1	ZINC000000014895	c1ccccc1
Cc3cc1COC(=O)c1c(Sc2ccc(C(C)(C)C)cc2)n3	ZINC000000028968	O=C2OCc3ccnc(Sc1ccccc1)c23
COc2cc(CN(C)Cc1ccncn1)ccc2OC[C@H](O)C[N@@](C)C(C)C	ZINC000011873282	C(NCc1ccncn1)c2ccccc2
CCn1c(C)nnc1S[C@@H](C)C(=O)Nc2cc(N(=O)=O)ccc2C	ZINC000000329251	O=C(CSc1nnc[nH]1)Nc2ccccc2
CSc1ccccc1N3C(=O)Cc2ccccc2C3=O	ZINC000000023113	O=C2Cc1ccccc1C(=O)N2c3ccccc3
O=C(CSc2nc1ccccc1s2)Nc3ccncc3	ZINC000000033408	O=C(CSc2nc1ccccc1s2)Nc3ccncc3
COc2cc(C(=O)/C=C/N1CC=CC1)cc(OC)c2OC	ZINC000000002035	O=C(C=CN1CC=CC1)c2ccccc2
FC(F)(F)C(=O)Nc1ccccc1C(=O)NCc2cccs2	ZINC000000041211	O=C(NCc1cccs1)c2ccccc2
Clc3ccc(S(=O)(=O)CCC(=O)N1CCc2ccccc12)cc3	ZINC000000224839	O=C(CCS(=O)(=O)c1ccccc1)N2CCc3ccccc23
C5CN=C(c4ccc(c3cnc(c2ccc(C1=NCCN1)cc2)o3)cc4)N5	ZINC000006536384	C5CN=C(c4ccc(c3cnc(c2ccc(C1=NCCN1)cc2)o3)cc4)N5
CC2=NC(=O)N[C@@H](c1ccccc1)C2C(=O)OCc3ccc(C)cc3	ZINC000000069738	O=C3NC(c1ccccc1)C(C(=O)OCc2ccccc2)C=N3
Cc3cc(C)n(c2nc1n(C)c(=O)n(C)c(=O)c1n2C)n3	ZINC000000068607	O=c3[nH]c(=O)c2[nH]c(n1cccn1)nc2[nH]3
CC[N@]3C[C@H](Nc2nc(N)nc1CCNCCc12)[C@@H](OC)C3	ZINC000072458384	C3CC(Nc2ncnc1CCNCCc12)CN3
Cc3cc(=O)n([C@@H](NC(=O)c1ccccc1)C(=O)c2ccccc2)cn3	ZINC000000044936	O=C(NC(C(=O)c1ccccc1)n2cnccc2=O)c3ccccc3
Cc3ccc2cccc(SCC(=O)NC[C@@H]1CCCO1)c2n3	ZINC000000036162	O=C(CSc1cccc2cccnc12)NCC3CCCO3
COC(=O)CN(c2ccc(Oc1ccccc1)cc2)S(C)(=O)=O	ZINC000000064050	O(c1ccccc1)c2ccccc2
CC[N@]1CCC[C@@H]1CNC(=O)CCC3CCN(Cc2cnc(N(C)C)s2)CC3	ZINC000011949417	O=C(CCC2CCN(Cc1cncs1)CC2)NCC3CCCN3
Brc3cccc(n2[nH]c(=O)/c(=C/c1ccccc1)c2=O)c3	ZINC000000071227	O=c2[nH]n(c1ccccc1)c(=O)c2=Cc3ccccc3
COc1ccccc1c2nnc(SCC(=O)OC(C)C)o2	ZINC000000035522	c2ccc(c1nnco1)cc2
Nc2c(C(=O)NCc1cccnc1)sc(=S)n2c3ccccc3	ZINC000000075239	O=C(NCc1cccnc1)c3cn(c2ccccc2)c(=S)s3
O=C(CSC1=NCCS1)Nc3sc2CCCCc2c3C#N	ZINC000000033221	O=C(CSC1=NCCS1)Nc3cc2CCCCc2s3
FC(F)(F)c3ccnc(NCCN2C(=O)CC1(CCCC1)C2=O)n3	ZINC000000066473	O=C2CC1(CCCC1)C(=O)N2CCNc3ncccn3
C[C@@H]4CCC[N@@](CC(=O)N3CCC(c2ncc1CNCCc1n2)CC3)C4	ZINC000019496500	O=C(CN1CCCCC1)N4CCC(c3ncc2CNCCc2n3)CC4
C[n+]1ccccc1NC(=O)c3ccc(C(=O)Nc2cccc[n+]2C)cc3	ZINC000001694052	O=C(Nc1ccccn1)c3ccc(C(=O)Nc2ccccn2)cc3
COC(=O)c/1c(C)[nH]c(=O)c\1=C/c2cc(OC)c(OC)c(OC)c2	ZINC000000112555	O=c1[nH]ccc1=Cc2ccccc2
CC(=O)CSc2nc(c1cccs1)cc(C(F)(F)F)c2C#N	ZINC000000069826	c2ccc(c1cccs1)nc2
Cc3ccc([C@@H](O)c2nc1CCCc1cc2C)cc3	ZINC000000005386	C3Cc2ccc(Cc1ccccc1)nc2C3
Clc2ccc(OCC(=O)Nc1nccs1)c(Cl)c2	ZINC000000027612	O=C(COc1ccccc1)Nc2nccs2
COC(=O)c1cc(S(=O)(=O)C(C)C)c(S(C)(=O)=O)s1	ZINC000000125662	c1ccsc1
CC[N@]1CCC[C@@H]1CN(CC2CCN(CCOC)CC2)C(=O)CSC	ZINC000012056164	C2CNC(CNCC1CCNCC1)C2
Clc4ccc(C3(Nc1ccccc1)C(=O)c2ccccc2C3=O)cc4	ZINC000000280740	O=C2c1ccccc1C(=O)C2(Nc3ccccc3)c4ccccc4
C[C@@H]5Cc4cc(CN3CCC(c2nnc1CCNCCn12)CC3)ccc4O5	ZINC000019709409	C5Cc4nnc(C3CCN(Cc2ccc1OCCc1c2)CC3)n4CCN5
C[C@H]2Cc1ccccc1N2C(=O)Cn3nc(N(=O)=O)cc3C	ZINC000000037369	O=C(Cn1cccn1)N2CCc3ccccc23
Nc2ncc(Sc1ncc[nH]1)s2	ZINC000000013670	S(c1cncs1)c2ncc[nH]2
Cn3ncc(C12CCN(CC1)C2)n3	ZINC000000013300	C2CC3(c1cn[nH]n1)CCN2C3
CN(c1cccc(C)c1)c2ncnc3n[nH]cc23	ZINC000000021995	N(c1ccccc1)c2ncnc3n[nH]cc23
C(c2ccc(C[n+]1ccccc1)c3nsnc23)[n+]4ccccc4	ZINC000000281767	C(c2ccc(C[n+]1ccccc1)c3nsnc23)[n+]4ccccc4
NC(=N)c2ccc(NCCCNc1ccc(C(N)=N)cc1)cc2	ZINC000001552535	C(CNc1ccccc1)CNc2ccccc2
CCc3cc(N2CC[C@@H](N1CCN(C)CC1)[C@H](O)C2)nc(N(C)C)n3	ZINC000071730226	C3CN(C2CCN(c1ccncn1)CC2)CCN3
NC(=N)NC(=N)Nc1ccc(OC(F)(F)F)cc1	ZINC000002574888	c1ccccc1
Cc3cc(=O)oc4cc(OC(=O)c2cc1ccccc1oc2=O)ccc34	ZINC000000150287	O=C(Oc2ccc1ccc(=O)oc1c2)c4cc3ccccc3oc4=O
CN(C)CCNC(=O)c2ccc(OC1CCN(C)CC1)c(Cl)c2	ZINC000011818696	C2CC(Oc1ccccc1)CCN2
CC(=O)Nc1c(=O)n(C)c2cssc12	ZINC000000000868	O=c2cc1sscc1[nH]2
CC(=O)Oc1cccc(OC(C)=O)c1OC(C)=O	ZINC000000000869	c1ccccc1
COc2nc1nonc1nc2Nc3ccc(C)cc3	ZINC000000054284	N(c1ccccc1)c3cnc2nonc2n3
CCOC(=O)C[n+]2ccc(c1cc[n+](CC(=O)OCC)cc1)cc2	ZINC000003077526	c2cc(c1ccncc1)ccn2
C[C@@H](O)Cn1c(C)ncc1N(=O)=O	ZINC000000000711	c1c[nH]cn1
CC(=O)Nc2ccc(OC(=O)c1ccccc1O)cc2	ZINC000000000865	O=C(Oc1ccccc1)c2ccccc2
O=c3n(CN(c1ccccc1)c2ccccc2)c(=O)c4ccccc34	ZINC000000045076	O=c3n(CN(c1ccccc1)c2ccccc2)c(=O)c4ccccc34
NC(=N)c3ccc(N2CCN(c1ccc(C(N)=N)cc1)CC2)cc3	ZINC000001491938	C2CN(c1ccccc1)CCN2c3ccccc3
Cc2nnc(SCC(=O)Nc1ccc(OC(F)(F)F)cc1)s2	ZINC000000081266	O=C(CSc1nncs1)Nc2ccccc2
Oc3ccc(NC2Cc1ccccc1C2)cc3	ZINC000000009651	C2C(Nc1ccccc1)Cc3ccccc23
COc2ccc1ncn(CCNC(C)=O)c1c2	ZINC000000008256	c2ccc1[nH]cnc1c2
COCc2cc(C)n(CC(=O)Nc1ccc(OC)cc1)c(=O)c2C#N	ZINC000000098844	O=C(Cn1ccccc1=O)Nc2ccccc2
Nc2ccc(S(=O)(=O)c1ccc(N(=O)=O)cc1)cc2	ZINC000000056591	O=S(=O)(c1ccccc1)c2ccccc2
CC[N@]1CCC[C@@H]1CNC(=O)CCC4CCN(Cc3ccc2nonc2c3)CC4	ZINC000012196967	O=C(CCC3CCN(Cc2ccc1nonc1c2)CC3)NCC4CCCN4
CCNc1nsc2ccccc12	ZINC000000001401	c2ccc1sncc1c2
CC(C)N3CCC([N@]2CCC[C@@H](C(=O)N(C)Cc1c(C)nn(C)c1C)C2)CC3	ZINC000011842127	O=C(NCc1cn[nH]c1)C3CCCN(C2CCNCC2)C3
CC(C)[C@H]2OC(=O)[C@H](Cc1ccccc1)N(C)C2=O	ZINC000000005908	O=C2COC(=O)C(Cc1ccccc1)N2
Cc2cc1nc(N)nc(N)n1n2	ZINC000000001242	c2cc1ncncn1n2
Cc3nn2c(=O)c(=C/c1ccc(N(=O)=O)cc1)/sc2nc3=O	ZINC000000055718	O=c3cnn2c(=O)c(=Cc1ccccc1)sc2n3
Cc2c(C)c(=O)c(Cc1cccnc1)c(C)c2=O	ZINC000000004541	O=c2ccc(=O)c(Cc1cccnc1)c2
Nc3nc(OCc1ccccc1)c2[nH]c(=O)[nH]c2n3	ZINC000000021195	O=c3[nH]c2ncnc(OCc1ccccc1)c2[nH]3
CCn1c(Br)nc2n(C)c(=O)n(C)c(=O)c12	ZINC000000039866	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
Cc2cc1CCCS(=O)(=O)c1cc2S(N)(=O)=O	ZINC000000001718	O=S2(=O)CCCc1ccccc12
O=N(=O)c2cccc3c(=O)n(CCOc1ccccc1)c(=O)c23	ZINC000000033253	O=c2n(CCOc1ccccc1)c(=O)c3ccccc23
CCc1ccccc1NC(=O)COc2ccc(Br)cc2	ZINC000000037567	O=C(COc1ccccc1)Nc2ccccc2
COc2ccc(n1cnnn1)c(OC)c2	ZINC000000034941	c2ccc(n1cnnn1)cc2
COc2cc(OC)cc(C(=O)NC(=S)Nc1nnn(C)n1)c2	ZINC000000523131	O=C(NC(=S)Nc1nn[nH]n1)c2ccccc2
Cc2cc(Br)c(N1C(=O)CCC1=O)c(Br)c2	ZINC000000082456	O=C1CCC(=O)N1c2ccccc2
CN(C)CCN(C)C(=O)c3cccc(OC2CCN(C1CCC1)CC2)c3	ZINC000011817507	C3CC(N2CCC(Oc1ccccc1)CC2)C3
Clc3ccc(CSc2nc1cc(Cl)c(Cl)cc1[nH]2)cc3	ZINC000000155123	C(Sc2nc1ccccc1[nH]2)c3ccccc3
CCCN4CCN(c3nnc(n1cccc1CNC2CCCC2)s3)CC4	ZINC000007002074	C4CCC(NCc1cccn1c3nnc(N2CCNCC2)s3)C4
CN4CCN(C(=O)[C@@H]3CCC[N@](C2CCN(CCn1cncn1)CC2)C3)CC4	ZINC000071753434	O=C(C3CCCN(C2CCN(CCn1cncn1)CC2)C3)N4CCNCC4
O=C(NCc1cccnc1)C(\NC(=O)c2ccccc2)=C/c3ccco3	ZINC000000037894	O=C(NCc1cccnc1)C(NC(=O)c2ccccc2)=Cc3ccco3
O\N=C/c2cc[n+](CC[n+]1ccc(\C=N\O)cc1)cc2	ZINC000017023496	C(C[n+]1ccccc1)[n+]2ccccc2
C4CCN(CC1OCC3(CO1)COC(CN2CCCCC2)OC3)CC4	ZINC000004401541	C4CCN(CC1OCC3(CO1)COC(CN2CCCCC2)OC3)CC4
C(Oc2ccc(\C=N\n1cnnc1)cc2)c3cccc4ccccc34	ZINC000000048583	C(Oc2ccc(C=Nn1cnnc1)cc2)c3cccc4ccccc34
COc1cc(CC=C)c(OC)c2OCOc12	ZINC000000000048	C2Oc1ccccc1O2
CC(C)N4CCC(C(=O)N3CCC[C@@H](N2CCN(c1ccc(F)cc1)CC2)C3)CC4	ZINC000011937961	O=C(C1CCNCC1)N4CCCC(N3CCN(c2ccccc2)CC3)C4
CN(C)CCn1c(NCCO)nc2cc(C)c(C)cc12	ZINC000008410168	c2ccc1[nH]cnc1c2
CN(C)CCNC(=O)[C@@H]3C[C@H](CN1CCN(C)CC1)C[N@](CCc2ccccc2)C3	ZINC000023352267	C3CC(CN1CCNCC1)CN(CCc2ccccc2)C3
C=C4C[C@H]1COC(=O)[C@@]1(Cc3ccc2ccccc2c3)C4	ZINC000000007708	C=C4CC1COC(=O)C1(Cc3ccc2ccccc2c3)C4
O[C@@]3(CC(=O)c1ccco1)C(=O)N(CC=C)c2ccccc23	ZINC000000037416	O=C(CC1C(=O)Nc2ccccc12)c3ccco3
Cc3cc2nc(N)n(CCN1CCOCC1)c2cc3C	ZINC000008410163	C3CN(CCn1cnc2ccccc12)CCO3
O=C(Cn1c(=S)[nH]c2ccccc12)c3ccc(N(=O)=O)cc3	ZINC000000045452	O=C(Cn1c(=S)[nH]c2ccccc12)c3ccccc3
CN(C)[C@H]4CN(c3nc(c1ccccn1)nc2CCNCCc23)C[C@@H]4O	ZINC000072479073	C4CCN(c3nc(c1ccccn1)nc2CCNCCc23)C4
Clc4cccc(c3noc([C@H]2CCCN(C(=O)C1CCC1)C2)n3)c4	ZINC000000324560	O=C(C1CCC1)N4CCCC(c3nc(c2ccccc2)no3)C4
COc2ccc(OC)c([C@@H]1NC(=O)NC(C)=C1C(=O)OC(C)C)c2	ZINC000000044107	O=C2NC=CC(c1ccccc1)N2
O=C(COc2ccc1ccc(=O)oc1c2)Nc3ccccn3	ZINC000000051478	O=C(COc2ccc1ccc(=O)oc1c2)Nc3ccccn3
COc2ccc(OC[C@H](O)CN(C)C)c(CNCCc1ccccc1F)c2	ZINC000011946431	C(Cc1ccccc1)NCc2ccccc2
N[C@@H](CCCN2CCN(c1ncc(F)cn1)CC2)c3ccc(F)cc3	ZINC000013730936	C(CCc1ccccc1)CN3CCN(c2ncccn2)CC3
CCN4CCC(NC2C1CC3CC(C1)CC2C3)CC4	ZINC000000276969	C4CC(NC2C1CC3CC(C1)CC2C3)CCN4
Brc2ccc(C(=O)NC(=S)N[C@@H]1CCSC1=O)o2	ZINC000000314750	O=C(NC(=S)NC1CCSC1=O)c2ccco2
CN(C)CCCn1c(C)c(C)c2c(NCCO)ncnc12	ZINC000005348259	c2ncc1cc[nH]c1n2
C[C@@H]3[C@@H]2CC[C@]1(C)C=CC(=O)C(C)=C1[C@@H]2OC3=O	ZINC000000000707	O=C3CC2CCC1C=CC(=O)C=C1C2O3
C[N@]1CCC[C@H]1CCNCc3c(C(=O)N2CCOCC2)nc4c(C)cccn34	ZINC000019225655	O=C(N1CCOCC1)c3nc2ccccn2c3CNCCC4CCCN4
COC(=O)CNC(=O)c1cccc(OC)c1	ZINC000000030031	c1ccccc1
COc3cccc(C(=O)Nc2nc1ccccc1s2)c3	ZINC000000030033	O=C(Nc2nc1ccccc1s2)c3ccccc3
Clc4ccc(\C=N\n3cnc2n(c1ccccc1)ncc2c3=N)cc4	ZINC000000154527	N=c3n(N=Cc1ccccc1)cnc4n(c2ccccc2)ncc34
CC[C@H](C(=O)N1C[C@@H](C)O[C@H](C)C1)c2ccccc2	ZINC000000030789	O=C(Cc1ccccc1)N2CCOCC2
COc1ccccc1OC[C@@H](O)C[N@@](C)C[C@@H](O)CN	ZINC000005248151	c1ccccc1
COC(=O)C4[C@@H](c1cccnc1)n3nc(c2ccccc2)nc3N=C4C	ZINC000000066340	C3C=Nc2nc(c1ccccc1)nn2C3c4cccnc4
COc2ccc1[nH]c(C(N)=O)c(OC(C)C)c1c2	ZINC000000020026	c2ccc1[nH]ccc1c2
CCOc1ccccc1NC(=O)c2cccs2	ZINC000000029352	O=C(Nc1ccccc1)c2cccs2
C[C@@H](C#Cc2ccc(Oc1ccc(F)cc1)o2)N(O)C(N)=O	ZINC000000015683	O(c1ccccc1)c2ccco2
Cc4cc(=O)n3[C@@H]([C@H]1CCC=CC1)N=C(NCCN2CCCCC2)Nc3n4	ZINC000009289477	O=c4ccnc3NC(NCCN1CCCCC1)=NC(C2CCC=CC2)n34
Cn4c1ccccc1c5nnc(SCc3ccc2nonc2c3)nc45	ZINC000000210910	C(Sc1nnc3c(n1)[nH]c2ccccc23)c5ccc4nonc4c5
CCN(CC)CC(=O)N1CCN(C(=O)CN(CC)CC)CC1	ZINC000000190575	C1CNCCN1
Fc2ccc(NC(=S)NNc1c(Cl)cncc1Cl)cc2	ZINC000000075957	S=C(NNc1ccncc1)Nc2ccccc2
CCOC(=O)CNc1nc(N)nc2ccccc12	ZINC000000025611	c2ccc1ncncc1c2
Cc1ccc(N(=O)=O)cc1S(=O)(=O)n2ccnc2	ZINC000000051872	O=S(=O)(c1ccccc1)n2ccnc2
N#Cc3ccc(Sc2nc1ccccc1[nH]2)cc3C#N	ZINC000000034222	S(c1ccccc1)c3nc2ccccc2[nH]3
Cc4ccc(c2nnc(n1ncc(C#N)c1N)c3ccccc23)cc4	ZINC000000038236	c4ccc(c2nnc(n1cccn1)c3ccccc23)cc4
Clc4ccc([C@@H]2Nc1ccccc1C(=O)N2Cc3ccccc3)cc4	ZINC000000104565	O=C3N(Cc1ccccc1)C(c2ccccc2)Nc4ccccc34
Fc2ccc(S(=O)(=O)NCCc1ccccc1)cc2	ZINC000000029199	O=S(=O)(NCCc1ccccc1)c2ccccc2
COc2nncc(c1cnnc(SC)n1)n2	ZINC000000061027	c2nncc(c1cnncn1)n2
CC[C@@H](C)Nc3nnnc4c2cc1COC(C)(C)Cc1nc2sc34	ZINC000000331075	C4Cc3nc2sc1cnnnc1c2cc3CO4
CCC(=O)Nc3ccc2nc(SCC(=O)N1CCCC1)sc2c3	ZINC000000331770	O=C(CSc2nc1ccccc1s2)N3CCCC3
ClC1=CC[C@H]3[C@@H](C1)C(=O)N(CCOC(=O)Cc2ccccc2)C3=O	ZINC000000105286	O=C(Cc1ccccc1)OCCN3C(=O)C2CC=CCC2C3=O
CC(C)N4CCC(N3CC[N@@](Cc1cn(CC(N)=O)c2ccccc12)C[C@@H]3CCO)CC4	ZINC000019228285	C4CC(N3CCN(Cc1c[nH]c2ccccc12)CC3)CCN4
CNc4nc([C@@H]2CCC[N@@](CC(=O)N(Cc1ccccc1)C(C)C)C2)nc3CCNCc34	ZINC000019710473	O=C(CN3CCCC(c2ncc1CNCCc1n2)C3)NCc4ccccc4
COC(=O)[C@@H]2C[C@H]1CC[C@H](O)C[C@H]1[N@]2Cc4ccc(N3CCN(C)CC3)cc4	ZINC000008679901	C1CCC2C(C1)CCN2Cc4ccc(N3CCNCC3)cc4
COc3cc(c2nc1ccccc1c(=O)n2N)cc(OC)c3OC	ZINC000000268021	O=c2[nH]c(c1ccccc1)nc3ccccc23
CNc2nc1n(C)c(=O)[nH]c(=O)c1n2CCCc3ccccc3	ZINC000000042880	O=c3[nH]c(=O)c2n(CCCc1ccccc1)cnc2[nH]3
COc3ccc(CN2CCC(N1CCN(C)CC1)CC2)c(OC)c3	ZINC000019889829	C3CN(C2CCN(Cc1ccccc1)CC2)CCN3
COc1ccccc1OCCN(C#N)c2nc(Cl)nc(N(C)C)n2	ZINC000000267488	C(COc1ccccc1)Nc2ncncn2
O=C(N(CC#N)CC#N)c1ccco1	ZINC000000029993	c1ccoc1
CCCc1[nH]c(=O)oc1c2ccncc2	ZINC000000004119	O=c2[nH]cc(c1ccncc1)o2
FC(F)(F)c2cccc(NC(=O)C(=S)NCc1ccccc1)c2	ZINC000000031471	O=C(Nc1ccccc1)C(=S)NCc2ccccc2
OCCN1CCOCCN(CCO)CCOCC1	ZINC000002366042	C1COCCNCCOCCN1
CCn3cc(CNCc1ccccc1OC[C@@H](O)CN2CCCCC2)cn3	ZINC000012112080	C3CCN(CCCOc1ccccc1CNCc2cn[nH]c2)CC3
Clc4ccc3oc(c2cc(Cl)cc1COCOc12)cc(=O)c3c4	ZINC000000049571	O=c3cc(c2cccc1COCOc12)oc4ccccc34
Fc3ccc(CNc2nc(c1ccccc1)cc(C(F)(F)F)n2)cc3	ZINC000000213184	C(Nc2nccc(c1ccccc1)n2)c3ccccc3
COc2ccc(c1nc(SC)n(C)c(=O)c1C#N)cc2OC	ZINC000000067972	O=c2cc(c1ccccc1)nc[nH]2
COc1ccccc1C(=O)Nc3ccc2OCOc2c3	ZINC000000035577	O=C(Nc2ccc1OCOc1c2)c3ccccc3
CN(C)CCN(Cc2cc1cc(C)ccc1[nH]c2=O)C(=S)NCCCN3CCOCC3	ZINC000006408147	O=c2[nH]c1ccccc1cc2CNC(=S)NCCCN3CCOCC3
Cc4cccc5cc(CNCCCN1CCCC1=O)c(N3CC[N@]2CCC[C@@H]2C3)nc45	ZINC000012130112	O=C1CCCN1CCCNCc3cc2ccccc2nc3N5CCN4CCCC4C5
NS(=O)(=O)c2ccc(NC(=O)CCc1ccccc1)cc2	ZINC000000035573	O=C(CCc1ccccc1)Nc2ccccc2
CC2(C)CC(O)(C1(O)CC(C)(C)NC(C)(C)C1)CC(C)(C)N2	ZINC000000198752	C2CC(C1CCNCC1)CCN2
Cc3cc(CN2CCC(Cn1cc(CN)nn1)CC2)n(C)n3	ZINC000023231374	C2CN(Cc1ccn[nH]1)CCC2Cn3ccnn3
Fc3ccc(Nc1ccccc1C(=O)OCC(=O)c2ccccc2)cc3	ZINC000000072675	O=C(COC(=O)c1ccccc1Nc2ccccc2)c3ccccc3
Nc2c1[C@@H](O)CCCc1nc3ccccc23	ZINC000000003711	C3CCc2nc1ccccc1cc2C3
Cc3n[nH]c(SCC(=O)Nc2nc(c1ccccc1)cs2)n3	ZINC000000051943	O=C(CSc1ncn[nH]1)Nc3nc(c2ccccc2)cs3
CN(C)CC[C@@H](CNC1=NCCN1)c2cccc3ccccc23	ZINC000006437062	C3CN=C(NCCc1cccc2ccccc12)N3
Cc3ccc(n2c(C)cc(C(=S)N1CCOCC1)c2C)cc3Cl	ZINC000000196751	S=C(N1CCOCC1)c3ccn(c2ccccc2)c3
O=C(Cn2nnc(c1ccccc1)n2)OCc3ccc(N(=O)=O)cc3	ZINC000000032890	O=C(Cn2nnc(c1ccccc1)n2)OCc3ccccc3
Cc2nn(C(=O)c1ccc(Cl)c(Cl)c1)c(N)c2c3ccccc3	ZINC000000106481	O=C(c1ccccc1)n3cc(c2ccccc2)cn3
NCCn3ncc4c(N2CCN(Cc1ccccc1)CC2)ncnc34	ZINC000026421591	C3CN(c1ncnc2[nH]ncc12)CCN3Cc4ccccc4
CN(C)C(=S)SCCn1c(N)nc(N(C)C)nc1=O	ZINC000000497254	O=c1ncnc[nH]1
CNC(=S)[C@]2(c1cccnc1)CCCCC2=O	ZINC000000010523	O=C1CCCCC1c2cccnc2
Cc1nonc1N(Cc2ccc(F)cc2)S(=O)(=O)c3ccccc3	ZINC000000135790	O=S(=O)(N(Cc1ccccc1)c2cnon2)c3ccccc3
Cn2c(=O)oc3cc(S(=O)(=O)Nc1ccccc1F)ccc23	ZINC000000035202	O=c3[nH]c2ccc(S(=O)(=O)Nc1ccccc1)cc2o3
Cc1ccccc1NC(=O)C[N+]34CC[N+](CC(=O)Nc2ccccc2C)(CC3)CC4	ZINC000001768510	O=C(C[N+]23CC[N+](CC(=O)Nc1ccccc1)(CC2)CC3)Nc4ccccc4
Cn1ncc(N(=O)=O)c1C(=O)Nc2cccc(C(F)(F)F)c2	ZINC000000033416	O=C(Nc1ccccc1)c2ccn[nH]2
CC2=N[C@@H]3CCCc4nc1ccccc1c(N2)c34	ZINC000000012063	C2CC1N=CNc3c1c(C2)nc4ccccc34
CCN3CCN(C[C@@H](O)COc2ccc(C[N@@](C)C1CCOCC1)cc2OC)CC3	ZINC000020201577	C(COc2ccc(CNC1CCOCC1)cc2)CN3CCNCC3
CSc2c(c1ccccn1)c(N)nn2C(=O)C3CC3	ZINC000000130029	O=C(C1CC1)n3cc(c2ccccn2)cn3
OC[C@@H]1CCCN1C(=O)C4CCN(C3CCN(CCCc2ccccc2)CC3)CC4	ZINC000020455443	O=C(C3CCN(C2CCN(CCCc1ccccc1)CC2)CC3)N4CCCC4
CN3CCN(c1ncc(Br)cc1CNC2CC2)CC3	ZINC000051399563	C3CN(c1ncccc1CNC2CC2)CCN3
Fc4ccc(N3CCN(C(=O)Nc1cccc2ccccc12)CC3)cc4	ZINC000000311669	O=C(Nc1cccc2ccccc12)N4CCN(c3ccccc3)CC4
Fc3nc(N1CCOCC1)c(F)c(Oc2ccc(Cl)cc2)c3F	ZINC000000203860	C3CN(c2cc(Oc1ccccc1)ccn2)CCO3
O=C(N1CCCCC1)c2ccccc2Sc3ccc(N(=O)=O)cc3	ZINC000000316469	O=C(N1CCCCC1)c2ccccc2Sc3ccccc3
COC(=O)c2ccc(N(=O)=O)c(Oc1ccc(Cl)cc1Cl)c2	ZINC000000120640	O(c1ccccc1)c2ccccc2
Cc2ccc(S(=O)(=O)Nc1c(Cl)cccc1Cl)c(C)c2F	ZINC000000140444	O=S(=O)(Nc1ccccc1)c2ccccc2
COc2ccc(\C=N\S(=O)(=O)c1cccs1)cc2OC	ZINC000000055578	O=S(=O)(N=Cc1ccccc1)c2cccs2
Cn2nc(C(F)(F)F)c(c1ccccc1)c2NC(=O)c3ccccc3	ZINC000000147867	O=C(Nc1[nH]ncc1c2ccccc2)c3ccccc3
CN4CCN(C[C@@H]3C[N@@](Cc2cnc(c1ccccn1)nc2)C[C@@H]3CO)CC4	ZINC000092107966	C4CN(CC3CCN(Cc2cnc(c1ccccn1)nc2)C3)CCN4
CCN(CC)CCCNC2=N[C@@H]1CS(=O)(=O)C[C@@H]1S2	ZINC000002958803	O=S2(=O)CC1SC=NC1C2
Fc2ccc(F)c(NC(=O)NCC1CCCCC1)c2	ZINC000000023541	O=C(NCC1CCCCC1)Nc2ccccc2
COC(=O)CCC(=O)N1CCc2ccccc12	ZINC000000027609	C2Cc1ccccc1N2
Cc1ccccc1Nc3nc(c2ccc(C)c(N(=O)=O)c2)cs3	ZINC000000028955	N(c1ccccc1)c3nc(c2ccccc2)cs3
NC(=N)c4cccc([C@@H]3Oc1ccccc1N(CCCCCN2CCOCC2)C3=O)c4	ZINC000012355160	O=C3C(c1ccccc1)Oc2ccccc2N3CCCCCN4CCOCC4
Clc3ccc2NC(=O)CN=C(c1ccc[nH]1)c2c3	ZINC000000005155	O=C3CN=C(c1ccc[nH]1)c2ccccc2N3
COc3ccc2CCC1(CCN(CCCN(C)C)CC1)Cc2c3	ZINC000001637894	C1CC3(CCN1)CCc2ccccc2C3
CNC(=O)CN3CCC(CN(C)c2cc(n1cccn1)nc(N)n2)CC3	ZINC000092914705	C3CC(CNc2cc(n1cccn1)ncn2)CCN3
CCN3CCC(Cn2cc(C[N@]1CCC[C@@H](C(N)=O)C1)nn2)CC3	ZINC000023339851	C3CCN(Cc2cn(CC1CCNCC1)nn2)CC3
COCCN3CCC(C[N@@](Cc1ccncc1)C2CCOCC2)CC3	ZINC000012303312	C3CC(CN(Cc1ccncc1)C2CCOCC2)CCN3
CCOC(=O)C1=C(C)N(CCO)C(=O)N[C@@H]1c2ccccc2	ZINC000000037310	O=C2NC=CC(c1ccccc1)N2
CC(=O)c1cc(Cl)cc(Cl)c1OC(=O)c2ccccc2Cl	ZINC000000066692	O=C(Oc1ccccc1)c2ccccc2
CN(C(C)=O)c2ccc(NC(=O)c1ccccc1N(=O)=O)cc2	ZINC000000038830	O=C(Nc1ccccc1)c2ccccc2
COC(=O)Cn1c(C)cc(C=O)c1C	ZINC000000009390	c1cc[nH]c1
Cc1c(O)c(=O)ccn1CC=C	ZINC000000004379	O=c1cc[nH]cc1
COC(=O)c1ccccc1NS(C)(=O)=O	ZINC000000029512	c1ccccc1
O=C2N=C(N1CCOCC1)CN2Cc3ccccc3	ZINC000000022146	O=C2N=C(N1CCOCC1)CN2Cc3ccccc3
CS(=O)(=O)Nc2ccc(OCc1ccccc1)cc2	ZINC000000029518	C(Oc1ccccc1)c2ccccc2
CC(C)N2CCC(NC(=O)CSc1nnnn1CCN(C)C)CC2	ZINC000074392813	O=C(CSc1nnn[nH]1)NC2CCNCC2
CN(C)c4nc1CNCCc1c(NC3CCN(C[C@@H]2CCCO2)CC3)n4	ZINC000067868695	C4COC(CN3CCC(Nc2ncnc1CNCCc12)CC3)C4
CCOC(=O)n1ccn(C)c1=S	ZINC000000001091	S=c1[nH]cc[nH]1
O=c2[nH]c(=O)c1ccccc1o2	ZINC000000001098	O=c2[nH]c(=O)c1ccccc1o2
CN3Cc1c(C(=O)OC(C)(C)C)ncn1c2ccsc2C3=O	ZINC000000003945	O=C2NCc1cncn1c3ccsc23
CC1(C)CC(O)CC(C)(C)N1O	ZINC000000005575	C1CCNCC1
COC(=O)c2cc(\C=N\NS(=O)(=O)c1ccc(C)cc1)cn2C	ZINC000000112780	O=S(=O)(NN=Cc1cc[nH]c1)c2ccccc2
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)CCc3cccnc3	ZINC000011821842	O=C(CCc1cccnc1)NCC3CCN(C2CCNCC2)CC3
CO[C@@H]2Cc1c(O)cc(O)cc1O[C@H]2c3ccc(O)c(O)c3	ZINC000000001654	C2Cc1ccccc1OC2c3ccccc3
NCCn4cc(C(=O)N[C@H]2[C@H](O)C1(CCNCC1)c3ccccc23)nn4	ZINC000072166317	O=C(NC2CC1(CCNCC1)c3ccccc23)c4c[nH]nn4
Cn4nnc(c3nc(N1CCOCC1)nc(N2CCOCC2)n3)n4	ZINC000000054546	C4CN(c3nc(N1CCOCC1)nc(c2nn[nH]n2)n3)CCO4
OCc4cn(c3nc(N1CCOCC1)nc(N2CCOCC2)n3)nn4	ZINC000000054545	C4CN(c3nc(N1CCOCC1)nc(n2ccnn2)n3)CCO4
CC(=O)N(c1cc(C)on1)S(=O)(=O)c2ccc(N)cc2	ZINC000000000873	O=S(=O)(Nc1ccon1)c2ccccc2
CCOC(=O)c1ccc(N(C[C@@H](C)O)C[C@@H](C)O)cc1	ZINC000000000704	c1ccccc1
Clc3ccc(/N=C/c2ccc(OC(=O)c1ccccc1)cc2)cc3	ZINC000000061694	O=C(Oc2ccc(C=Nc1ccccc1)cc2)c3ccccc3
CC(=O)c2ccc1[nH]cc(CCN)c1c2	ZINC000000000870	c2ccc1[nH]ccc1c2
CCN(CC)CC/N=c1\ccn(O)c2cc(Cl)ccc12	ZINC000005846456	N=c1cc[nH]c2ccccc12
Cc1csc2[nH]c(=O)c(=O)[nH]c12	ZINC000000015867	O=c2[nH]c1ccsc1[nH]c2=O
Clc2ccc(C(=O)NC(=S)NCc1ccccc1)c(Cl)c2	ZINC000000067502	O=C(NC(=S)NCc1ccccc1)c2ccccc2
CCOC(=O)C(=C/c2ccc(c1ccc(OC)cc1N(=O)=O)o2)/C#N	ZINC000000036797	c2ccc(c1ccco1)cc2
CC(C)(C)NC(=O)c3sc2nc(c1cccs1)ccc2c3N	ZINC000000055386	c3csc(c2ccc1ccsc1n2)c3
CN(C)CCCNc2nc(N)c(N(=O)=O)c(N1CCN(C)CC1)n2	ZINC000004306015	C2CN(c1ccncn1)CCN2
Cc3ccc([C@@H](N(CC=C)c1ccccc1)C(=O)NC2CCCC2)cc3	ZINC000000270344	O=C(NC1CCCC1)C(Nc2ccccc2)c3ccccc3
Nc2ncnc3[nH]c(N1CCCCC1)nc23	ZINC000000048025	C3CCN(c2nc1cncnc1[nH]2)CC3
C[C@H]1CCc4c(C1)sc5ncn3c(CCc2ccccc2)nnc3c45	ZINC000000098659	C1CCc4c(C1)sc5ncn3c(CCc2ccccc2)nnc3c45
CN(C)CCn3cnc4nnc2ccc(C(=O)N1CCN(C)CC1)cc2c34	ZINC000096264259	O=C(N1CCNCC1)c4ccc3nnc2nc[nH]c2c3c4
O=C(Cn1nnc(N(=O)=O)n1)N(c2ccccc2)c3ccccc3	ZINC000000098277	O=C(Cn1ncnn1)N(c2ccccc2)c3ccccc3
CNc1nc(Br)cn2cc(C#N)nc12	ZINC000000005885	c2cn1ccnc1cn2
O=C(CCCc1ccccc1)N2CCOCC2	ZINC000000012163	O=C(CCCc1ccccc1)N2CCOCC2
CNc2nc1ccc(C)cn1c(=O)c2\C=N\O	ZINC000000048119	O=c1ccnc2ccccn12
COCCN3CC[C@@H](C[N@]2CCCN(c1ncccn1)CC2)C3	ZINC000019790643	C3CN(CC1CCNC1)CCN(c2ncccn2)C3
Cn1cncc1C(=O)Nc3ccc(OC(=O)c2ccnn2C)cc3	ZINC000000381100	O=C(Nc2ccc(OC(=O)c1ccn[nH]1)cc2)c3cnc[nH]3
CCc4nc(C)c(CN3CCC(N2CCC(C(=O)NCc1ccccn1)CC2)CC3)[nH]4	ZINC000011936570	O=C(NCc1ccccn1)C4CCN(C3CCN(Cc2cnc[nH]2)CC3)CC4
CN1CCC4(CC1)NC(=O)N(CN3CCC(CCc2ccc(C)cc2)CC3)C4=O	ZINC000012983901	O=C2NC1(CCNCC1)C(=O)N2CN4CCC(CCc3ccccc3)CC4
O=c2cc(N1CCOCC1)oc3ccccc23	ZINC000000004590	O=c2cc(N1CCOCC1)oc3ccccc23
COc2ccc(CNCc1ccc(C)o1)cc2OC[C@@H](O)CN3CCCC3	ZINC000012297946	C3CCN(CCCOc2cccc(CNCc1ccco1)c2)C3
CN(C)\N=C(/Cn2nnc(N1CCCC1)n2)c3ccc(Cl)cc3	ZINC000000089000	N=C(Cn2nnc(N1CCCC1)n2)c3ccccc3
CN4CCN(Cc3ccc(c2nc(CC(=O)NN1CCN(C)CC1)cs2)cc3)CC4	ZINC000062048292	O=C(Cc3csc(c2ccc(CN1CCNCC1)cc2)n3)NN4CCNCC4
CS(=O)(=O)c3ccc(C2=C(c1cccnc1)C(=O)CC2)cc3	ZINC000000007002	O=C2CCC(c1ccccc1)=C2c3cccnc3
Clc3ccc(C(=O)ON=C(c1cccs1)c2cccs2)cc3	ZINC000000133340	O=C(ON=C(c1cccs1)c2cccs2)c3ccccc3
Cc4ccc(C(=O)N(CCN2CCN(c1ccccc1)CC2)CCC(=O)N3CCNCC3)cc4	ZINC000045966934	O=C(CCN(CCN2CCN(c1ccccc1)CC2)C(=O)c3ccccc3)N4CCNCC4
CCN(CC)CCN(CCC(=O)N1CCNCC1)C(=O)c2ccc(C(F)(F)F)cc2	ZINC000045966634	O=C(CCNC(=O)c1ccccc1)N2CCNCC2
Cc5ccc(\C=N\N2C(=O)[C@H]1[C@@H]3C=C[C@H]([C@H]1C2=O)C34CC4)o5	ZINC000000036951	O=C2C1C4C=CC(C1C(=O)N2N=Cc3ccco3)C45CC5
CCOC(=O)c2c(C)nn(c1ccccc1)c2N	ZINC000000037420	c2ccc(n1cccn1)cc2
CC(=O)C1=C(C)OC(N)=C(C#N)[C@]13C(=O)Nc2ccc(Cl)cc23	ZINC000000037421	O=C2Nc1ccccc1C23C=COC=C3
Cc1ccccc1OC[C@H](O)CO	ZINC000000000450	c1ccccc1
C[C@H]4CN(C(=O)c2nc1sccn1c2CNCCCCCN3CCOCC3)C[C@@H](C)O4	ZINC000015075842	O=C(N1CCOCC1)c3nc2sccn2c3CNCCCCCN4CCOCC4
COc1ccccc1OC[C@@H]2CNC(=O)O2	ZINC000000000452	O=C2NCC(COc1ccccc1)O2
CC[N@]1CCC[C@@H]1CN(CC2CCN(CCOC)CC2)Cc3nccn3C	ZINC000019595638	C3CNC(CN(CC1CCNCC1)Cc2ncc[nH]2)C3
C[C@@H]3CN(c2ccc(NC(=S)NCc1ccco1)cc2)C[C@@H](C)O3	ZINC000000089170	S=C(NCc1ccco1)Nc3ccc(N2CCOCC2)cc3
O=C(CCCc1ccccc1)N[C@@H]2CCCCNC2=O	ZINC000000015121	O=C(CCCc1ccccc1)NC2CCCCNC2=O
COC(=O)c4ccc(c3nc(N)c2c(=O)oc1ccccc1c2n3)cc4	ZINC000000286135	O=c3oc1ccccc1c4nc(c2ccccc2)ncc34
C[C@@H](O)CN3CCC(CNCc2cnc(N1CCOCC1)nc2)CC3	ZINC000069329297	C3CC(CNCc2cnc(N1CCOCC1)nc2)CCN3
FC(F)(F)c3ccc(c1nnc2ccc(C(F)(F)F)cn12)cc3	ZINC000000039124	c3ccc(c1nnc2ccccn12)cc3
O=C2N(Cc1ccco1)Cc5c2[nH]c4cc(c3ccccc3)nn4c5=O	ZINC000000154998	O=C2N(Cc1ccco1)Cc5c2[nH]c4cc(c3ccccc3)nn4c5=O
C[C@@H](NC(=O)C(=O)NCCN(C)C)[C@@H](N1CCN(C)CC1)c2cccs2	ZINC000020287630	C2CN(Cc1cccs1)CCN2
Cc1cc(Cl)ccc1OCc3nc(c2cccc(N(=O)=O)c2)no3	ZINC000000099434	C(Oc1ccccc1)c3nc(c2ccccc2)no3
Cc2ccc(Cn1cnc(N(=O)=O)n1)cc2	ZINC000000037047	C(c1ccccc1)n2cncn2
Fc2c(CSC1=NCCN1)cccc2CSC3=NCCN3	ZINC000000140849	C3CN=C(SCc2cccc(CSC1=NCCN1)c2)N3
CC[C@H]1C(=O)NC(=O)[C@@]1(C)c2ccccc2	ZINC000000000296	O=C2CC(c1ccccc1)C(=O)N2
O[C@@H](CNC1CCCCC1)CSC[C@@H](O)CNC2CCCCC2	ZINC000004989801	C2CCC(NCCCSCCCNC1CCCCC1)CC2
COc4cccc([C@@H]1CNC[C@H]1c3cc(=O)[nH]c(N2CCN(C)CC2)n3)c4	ZINC000012326557	O=c4cc(C1CNCC1c2ccccc2)nc(N3CCNCC3)[nH]4
CCN(CC)C(=O)[C@@H]4CCC[N@@](Cc3ccc(C(=O)NCC2(N1CCOCC1)CCCCC2)c(=O)[nH]3)C4	ZINC000012052626	O=C(NCC2(N1CCOCC1)CCCCC2)c4ccc(CN3CCCCC3)[nH]c4=O
Cc2ccc(NC(=O)Nc1ccc(Cl)cc1Cl)cc2	ZINC000000042500	O=C(Nc1ccccc1)Nc2ccccc2
C1CC4(CCN1)CN(C(c2ccccc2)c3ccccc3)C4	ZINC000003955977	C1CC4(CCN1)CN(C(c2ccccc2)c3ccccc3)C4
CS(=O)(=O)c2cnc(NCC1CCNCC1)nc2[C@@H]3CCCNC3	ZINC000072477469	C3CNCC(c2ccnc(NCC1CCNCC1)n2)C3
COc3ccc2O[C@]1(CCC[N@@](C)CC1)CN(C(=O)[C@@H](C)N)Cc2c3	ZINC000012365989	C1CNCCC3(C1)CNCc2ccccc2O3
CC(C)(C)c2cc(OC(=O)c1ccccc1Br)ccc2O	ZINC000000364284	O=C(Oc1ccccc1)c2ccccc2
CCSc2nc1n(C)c(=O)[nH]c(=O)c1n2CCc3ccccc3	ZINC000000180719	O=c3[nH]c(=O)c2n(CCc1ccccc1)cnc2[nH]3
C5CN=C(c4ccc(C=C3CCN(c2ccc(C1=NCCN1)cc2)CC3)cc4)N5	ZINC000005933241	C5CN=C(c4ccc(C=C3CCN(c2ccc(C1=NCCN1)cc2)CC3)cc4)N5
Cc2cc(=O)oc3cc(OC(=O)\C=C\c1ccc(Cl)cc1)ccc23	ZINC000000064049	O=C(Oc2ccc1ccc(=O)oc1c2)C=Cc3ccccc3
COCC[N@@](CCO)CC2CCN(Cc1ccccc1OC)CC2	ZINC000012052826	C2CCN(Cc1ccccc1)CC2
Cc1ccccc1NC(=O)[C@H]2[C@H]3C[C@@](C)(NC2=O)Oc4ccccc34	ZINC000000072412	O=C1NC4CC(C1C(=O)Nc2ccccc2)c3ccccc3O4
CNC(=O)[C@@H]3C[C@@H](n2cc(COc1ccccc1CN(C)C)nn2)CN3	ZINC000067982097	C3CC(n2cc(COc1ccccc1)nn2)CN3
CC(=O)c4ccc(NC(=O)C2c1ccccc1Oc3ccccc23)cc4	ZINC000000030242	O=C(Nc1ccccc1)C3c2ccccc2Oc4ccccc34
CCOc3ccc(OCC)c(Cc2oc(c1ccccc1)nc2O)c3	ZINC000000042471	C(c1ccccc1)c3cnc(c2ccccc2)o3
Nc3nnc(SCC(=O)N1CCCc2ccccc12)s3	ZINC000000051805	O=C(CSc1nncs1)N2CCCc3ccccc23
CCOc3ccc(\C=N\N2CCN(c1ccccc1OC)CC2)cc3	ZINC000000046767	C2CN(c1ccccc1)CCN2N=Cc3ccccc3
Clc2cccc3CC[C@]1(COC(=N)N1)Cc23	ZINC000000006263	N=C3NC2(CCc1ccccc1C2)CO3
Cn1nnnc1SCCNC[C@]3(O)CCC[N@]2CCCC[C@@H]23	ZINC000063882716	C3CCN2CCCC(CNCCSc1nnn[nH]1)C2C3
COc2ccc(C1(CNC(C)=O)CCC(OC(C)=O)CC1)cc2OC	ZINC000000344047	C2CCC(c1ccccc1)CC2
CN4CCN(CC(C)(C)C[N@]3CCc2nc(c1ccncc1)[nH]c(=O)c2C3)CC4	ZINC000023093269	O=c4[nH]c(c1ccncc1)nc3CCN(CCCN2CCNCC2)Cc34
ClC(Cl)(Cl)[C@@H](NC(=O)c1ccccc1)n2cnccc2=O	ZINC000000040907	O=C(NCn1cnccc1=O)c2ccccc2
COC(=O)c2nnn(c1nonc1N)c2C(C)(C)C	ZINC000000034768	c2cn(c1cnon1)nn2
Cc1[nH]c(=O)c(C#N)c(C)c1CSCc2ccco2	ZINC000000032666	O=c2ccc(CSCc1ccco1)c[nH]2
CCN(C[C@@H]2CCC[N@@](CCc1cccc(F)c1)C2)C(=O)CN3CCC(O)CC3	ZINC000011996695	O=C(CN1CCCCC1)NCC3CCCN(CCc2ccccc2)C3
CC1(C)NC(=N)NC(=N)N1c3ccc(OCC(=O)N2CCOCC2)cc3	ZINC000001724842	N=C3NCN(c2ccc(OCC(=O)N1CCOCC1)cc2)C(=N)N3
O=C(N2CCC(N1CCOCC1)CC2)c4ccc(N[C@@H]3CCNC3)nc4	ZINC000067847019	O=C(N2CCC(N1CCOCC1)CC2)c4ccc(NC3CCNC3)nc4
CCC(=O)OC2(c1ccccc1)[C@@H](CN(C)C)CCC[C@@H]2CN(C)C	ZINC000001593611	C2CCC(c1ccccc1)CC2
COc4ccc(c3cc2cc(C)c(C#N)c(N1CCCC1)n2c3)cc4	ZINC000000034363	C4CCN(c2cccc3cc(c1ccccc1)cn23)C4
CCN4CCN(C(=O)c3ccc(N1CCNCC1)c(NS(=O)(=O)c2ccc(C)cc2)c3)CC4	ZINC000033033160	O=C(N1CCNCC1)c4ccc(N2CCNCC2)c(NS(=O)(=O)c3ccccc3)c4
COC(=O)c3sc2nc1CC[C@H](C)Cc1cc2c3N	ZINC000000035140	C3CCc2nc1sccc1cc2C3
COCC(=O)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN4CCN(c3ccccn3)CC4	ZINC000020503886	C1CN4CCC1C(CN3CCN(c2ccccn2)CC3)C4
O=C(O[C@@H](C(=O)c1ccccc1)c2ccccc2)C=Cc3ccccc3	ZINC000000265191	O=C(OC(C(=O)c1ccccc1)c2ccccc2)C=Cc3ccccc3
O=C(CN2CCC(CN1CCCCCC1)CC2)N4CCN(S(=O)(=O)c3ccccc3C#N)CC4	ZINC000032927282	O=C(CN2CCC(CN1CCCCCC1)CC2)N4CCN(S(=O)(=O)c3ccccc3)CC4
COc1ccccc1CCN2CCC(C[N@@](C)C[C@@H](O)CO)CC2	ZINC000011957151	C2CCN(CCc1ccccc1)CC2
CC[C@]2(c1ccccc1)NC(=O)N(C)C2=O	ZINC000000000453	O=C2NC(c1ccccc1)C(=O)N2
Oc2ccc1sc(=O)oc1c2	ZINC000000002181	O=c2oc1ccccc1s2
C[N+](C)(C)CCOC(=O)c1ccc(C(=O)OCC[N+](C)(C)C)cc1	ZINC000003632908	c1ccccc1
CC(=O)O/N=C(\N1CCOCC1)c3ccc2OCOc2c3	ZINC000000052659	N=C(N1CCOCC1)c3ccc2OCOc2c3
O=C1CCCN1S(=O)(=O)c2ccccc2	ZINC000000010405	O=C1CCCN1S(=O)(=O)c2ccccc2
CNC(=N)c3ccc(NC(=O)c2ccc(C(=O)Nc1ccc(C(=N)NC)cc1)cc2)cc3	ZINC000001684447	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
Cc2sc(NC(=O)Cc1ccccc1)c(C(N)=O)c2C	ZINC000000035368	O=C(Cc1ccccc1)Nc2cccs2
COc3ccc2c(Cl)c(C(=O)NCc1ccccc1)sc2c3	ZINC000000045996	O=C(NCc1ccccc1)c3cc2ccccc2s3
C[C@@H](CNC(=O)NC1CCN(CC(=O)N(C)C)CC1)N2CCOCC2	ZINC000069401485	O=C(NCCN1CCOCC1)NC2CCNCC2
COc3ccc(\C=N\N=c1\c(=O)[nH]c2ccccc12)cc3OC	ZINC000000032062	O=c2[nH]c1ccccc1c2=NN=Cc3ccccc3
COC(=O)CS(=O)(=O)c1ccc(C(=O)OC)cc1N(=O)=O	ZINC000000078128	c1ccccc1
Cc3ccc(NC(=O)CCN2C(=O)[C@@H]1CC=C(Cl)C[C@H]1C2=O)cc3	ZINC000000117675	O=C(CCN2C(=O)C1CC=CCC1C2=O)Nc3ccccc3
Cc1csc2nc(C)c(CO)n12	ZINC000000015471	c2cn1ccsc1n2
CCC2(CC)[C@@H](C#Cc1ccccc1)OC(=O)C(C)(C)C2=O	ZINC000000032882	O=C2CC(C#Cc1ccccc1)OC(=O)C2
Nn3c(COc1ccc(Cl)cc1)nc2ccccc2c3=O	ZINC000000032880	O=c2[nH]c(COc1ccccc1)nc3ccccc23
CCn2c1ccccc1[nH]c(=O)c3cccnc23	ZINC000000013192	O=c2[nH]c1ccccc1[nH]c3ncccc23
CN[C@H]3[C@@H](O)[C@@H](NC)[C@@H]2O[C@@]1(O)[C@@H](O[C@@H](C)CC1=O)O[C@H]2[C@@H]3O	ZINC000013783409	O=C3CCOC2OC1CCCCC1OC23
Cc2ccc(S(=O)(=O)CCC(=O)Nc1cccc(N(=O)=O)c1)cc2	ZINC000000224811	O=C(CCS(=O)(=O)c1ccccc1)Nc2ccccc2
CC(=O)Nc3ccc(c2n/c(=C/c1cccs1)c(=O)o2)cc3	ZINC000000032084	O=c2oc(c1ccccc1)nc2=Cc3cccs3
Cc2cc(C)n(CCOc1nonc1N)n2	ZINC000000050043	C(Cn1cccn1)Oc2cnon2
CC3CCN(CC(=O)N2CCN(C(=O)CN1CCC(C)CC1)CC2)CC3	ZINC000004895364	O=C(CN1CCCCC1)N3CCN(C(=O)CN2CCCCC2)CC3
COc2cccc(NC(=O)c1cc(N(=O)=O)n[nH]1)c2	ZINC000000031171	O=C(Nc1ccccc1)c2ccn[nH]2
CCOC(=O)NC(=O)c2cn(Cc1cccs1)c(=O)n(C)c2=O	ZINC000000169612	O=c2ccn(Cc1cccs1)c(=O)[nH]2
NC(=O)C2=CN(C(=O)Nc1ccc(Cl)cc1)CC[C@@H]2C(F)(F)F	ZINC000000077834	O=C(Nc1ccccc1)N2CCCC=C2
Cc2noc3NC(N)=C(C#N)[C@H](c1cc(Br)ccc1F)c23	ZINC000000204881	N2C=CC(c1ccccc1)c3cnoc23
CN(C)CCc1c[nH]c2ccc(C)cc12	ZINC000000057395	c2ccc1[nH]ccc1c2
Fc3ccc(NC(=O)c2ccc(S(=O)(=O)N1CCCC1)cc2)cc3	ZINC000000086592	O=C(Nc1ccccc1)c3ccc(S(=O)(=O)N2CCCC2)cc3
CC(=NNC(N)=N)c3ccc(N2CCN(c1ccc(C(C)=NNC(N)=N)cc1)CC2)cc3	ZINC000008627530	C2CN(c1ccccc1)CCN2c3ccccc3
O=C(Nc1nncs1)c2ccco2	ZINC000000047687	O=C(Nc1nncs1)c2ccco2
CCOC(=O)C3[C@@H](c1cc(OC)ccc1OC)n2nnnc2N=C3C	ZINC000000066925	C2C=Nc1nnnn1C2c3ccccc3
CC(C)NC(=O)c3c(NC(=O)c1ccccc1F)sc2CCCc23	ZINC000000068377	O=C(Nc2cc1CCCc1s2)c3ccccc3
COC(=O)C3=NN(C(=O)c1ccccc1F)[C@@](O)(c2ccccc2)C3	ZINC000000062932	O=C(N1N=CCC1c2ccccc2)c3ccccc3
C1CC1n3c(Cn2cncn2)nnc3C6CCN(C[C@@H]5[C@H]4CNC[C@H]45)CC6	ZINC000102661101	C1CC1n3c(Cn2cncn2)nnc3C6CCN(CC5C4CNCC45)CC6
CN(C)CCNc2n[n+](=O)c1ccc(C)cc1n2O	ZINC000034563133	O=[n+]1nc[nH]c2ccccc12
CCOC(CN1CCCCC1)OCC	ZINC000000032338	C1CCNCC1
Oc2ccc(\C=C\c1ccc(O)c(O)c1)cc2	ZINC000000014989	C(=Cc1ccccc1)c2ccccc2
C3CN=C(NC(C1CC1)C2CC2)O3	ZINC000000009708	C3CN=C(NC(C1CC1)C2CC2)O3
O=C(CCN1CCCCC1)NCNC(=O)CCN2CCCCC2	ZINC000004409144	O=C(CCN1CCCCC1)NCNC(=O)CCN2CCCCC2
COc3ccc2c(C)c(c1cccc(Br)c1)c(=O)oc2c3	ZINC000000057779	O=c2oc1ccccc1cc2c3ccccc3
Fc4ccc(c3cc(c1c[nH]nc1c2ccccn2)ccn3)cc4	ZINC000000003586	c4ccc(c3cc(c1c[nH]nc1c2ccccn2)ccn3)cc4
COC(=O)c3c(OC[C@@H]1CCC[N@@](C)C1)cc(=O)n4CCN(Cc2ccccc2OCC=C)CCc34	ZINC000012099811	O=c4cc(OCC1CCCNC1)cc3CCN(Cc2ccccc2)CCn34
Cc4ccc(C(=O)N2C(=O)[C@@H](c1ccccc1)Oc3ccccc23)cc4	ZINC000000069379	O=C3C(c1ccccc1)Oc2ccccc2N3C(=O)c4ccccc4
C[C@H]4CN(C(=O)c2nc1ccc(Cl)cn1c2CNCCCn3ccnc3C)C[C@@H](C)O4	ZINC000012434389	O=C(N1CCOCC1)c3nc2ccccn2c3CNCCCn4ccnc4
Clc3ccc(NC(=O)NCc2ccc1OCOc1c2)cc3	ZINC000000038341	O=C(NCc2ccc1OCOc1c2)Nc3ccccc3
O=C([C@@H]4C[C@H](N3CCN(c1ccnc2ccccc12)CC3)CN4)N5CCSC5	ZINC000022453848	O=C(C4CC(N3CCN(c1ccnc2ccccc12)CC3)CN4)N5CCSC5
O=C(NC[C@@H]1CCCO1)C4CCN(C3CCN(C2CCSCC2)CC3)CC4	ZINC000011815321	O=C(NCC1CCCO1)C4CCN(C3CCN(C2CCSCC2)CC3)CC4
Cc2csc(NS(=O)(=O)c1cccc(Cl)c1C)n2	ZINC000000027389	O=S(=O)(Nc1nccs1)c2ccccc2
COc1cc(N)cn[n+]1c2ccccc2	ZINC000000000908	c2ccc([n+]1ccccn1)cc2
Fc1ccccc1C(=O)Nc2ccccc2C(=O)NCc3ccccc3	ZINC000000130209	O=C(NCc1ccccc1)c2ccccc2NC(=O)c3ccccc3
C[N+](C)(C)CC(=O)N/N=C1\C\C(=N\NC(=O)C[N+](C)(C)C)c2ccccc12	ZINC000048547449	N=C1CC(=N)c2ccccc12
COc3c(C)cnc(CN2CCC(N1CCCCC1)(C(N)=O)CC2)c3C	ZINC000004626521	C3CCN(C2CCN(Cc1ccccn1)CC2)CC3
O=C(NCc1nnnn1c2ccccc2)[C@@H]4CC3(CCNCC3)CN4	ZINC000072158025	O=C(NCc1nnnn1c2ccccc2)C4CC3(CCNCC3)CN4
COc2ccc(OC)c(NC(=O)Nc1ccc(Cl)cc1Cl)c2	ZINC000000082274	O=C(Nc1ccccc1)Nc2ccccc2
Cc3cc(C)n(c1nncn1/N=C/c2ccccc2O)n3	ZINC000000054159	C(=Nn1cnnc1n2cccn2)c3ccccc3
Cc4ccc3sc(c2ccc(/N=C/c1ccccc1O)cc2)nc3c4	ZINC000000058444	C(=Nc3ccc(c2nc1ccccc1s2)cc3)c4ccccc4
O=C(Nc2ccc(C1=NN(CC#C)C(=O)SC1)cc2)c3ccccc3	ZINC000000341049	O=C3NN=C(c2ccc(NC(=O)c1ccccc1)cc2)CS3
COc3ccc(n2nc1C[S@@](=O)Cc1c2NC(=O)C(C)(C)C)cc3	ZINC000000212291	O=S3Cc2cn(c1ccccc1)nc2C3
CN(C)CCNc2c1CCCc1nc3ccccc23	ZINC000001780063	C3Cc2cc1ccccc1nc2C3
C(CNc2c1CCCc1nc3ccccc23)CN4CCOCC4	ZINC000001780068	C(CNc2c1CCCc1nc3ccccc23)CN4CCOCC4
Nc2nnc(SCC(=O)NCCc1ccccc1)s2	ZINC000000036095	O=C(CSc1nncs1)NCCc2ccccc2
Cc4nc(CN3CCN(C(=O)[C@@H]2CC1(CCNCC1)CN2)CC3)no4	ZINC000072141771	O=C(C2CC1(CCNCC1)CN2)N4CCN(Cc3ncon3)CC4
Cn4c(=O)n(C)c3ncn(CCN2CCC(N1CCCC1)CC2)c3c4=O	ZINC000066533714	O=c4[nH]c(=O)c3n(CCN2CCC(N1CCCC1)CC2)cnc3[nH]4
C[C@@H](Oc1ccccc1)C(=O)Nc2ccc(F)cc2	ZINC000000030642	O=C(COc1ccccc1)Nc2ccccc2
Nc1nonc1c4noc(CCCn3c(=O)c2ccccc2c3=O)n4	ZINC000000089357	O=c3n(CCCc2nc(c1cnon1)no2)c(=O)c4ccccc34
COC(=O)COc3ccc2c(c1ccccc1)cc(=O)oc2c3C	ZINC000000044638	O=c3cc(c1ccccc1)c2ccccc2o3
Cn2c(=O)\c(=C/C(=O)c1cccc(Br)c1)c3ccccc23	ZINC000000365897	O=C(C=c1c(=O)[nH]c2ccccc12)c3ccccc3
COc2ccc(C(=O)Nc1ccc(N(C)C(C)=O)cc1)c(OC)c2	ZINC000000031030	O=C(Nc1ccccc1)c2ccccc2
Cc2cc(C)n(/N=C/c1ccc(N(=O)=O)cc1)c(=O)c2C(N)=O	ZINC000000059007	O=c1ccccn1N=Cc2ccccc2
O=C(NCc1ccccc1)C(=C/c2c[nH]c3ccccc23)\C#N	ZINC000000020550	O=C(NCc1ccccc1)C=Cc2c[nH]c3ccccc23
CCCN3CCC(N[C@@H]1CCCc2nc(N(C)C)ncc12)CC3	ZINC000011772011	C3CC(NC1CCNCC1)c2cncnc2C3
c4ccc(c2c[n+]1ccccc1c3cccc[n+]23)cc4	ZINC000000245480	c4ccc(c2c[n+]1ccccc1c3cccc[n+]23)cc4
O=C2[O+]=NN(c1ccccc1)C2SC4N(c3ccccc3)N=[O+]C4=O	ZINC000002346568	O=C2[O+]=NN(c1ccccc1)C2SC4N(c3ccccc3)N=[O+]C4=O
Nc4cc[n+](Cc2nc1ccccc1nc2C[n+]3ccc(N)cc3)cc4	ZINC000020031106	C(c2nc1ccccc1nc2C[n+]3ccccc3)[n+]4ccccc4
Cc3c(N1CCNCC1)c(N)cc4c(=O)c(C(O)=O)cn(C2CC2)c34	ZINC000000008479	O=c3ccn(C1CC1)c4cc(N2CCNCC2)ccc34
CC(C)CN(CC(C)C)C1=CC(=O)OC12CCCCC2	ZINC000000036323	O=C2OC1(CCCCC1)C=C2
COc4ccc(\C=c3/sc2nc1c(C)cccc1n2c3=O)cc4O	ZINC000000034965	O=c3c(=Cc1ccccc1)sc4nc2ccccc2n34
Brc2ccc(C(=O)NCc1ccco1)cc2	ZINC000000037545	O=C(NCc1ccco1)c2ccccc2
Clc4cccc(c3ccc2[nH]c(=O)n(Cc1ccccc1)c2c3)c4	ZINC000000026388	O=c3[nH]c2ccc(c1ccccc1)cc2n3Cc4ccccc4
Brc3ccc(c1csc2ncn(CC=C)c(=O)c12)cc3	ZINC000000098799	O=c2[nH]cnc3scc(c1ccccc1)c23
O=C(COc1nsnc1N2CCOCC2)N3CCOCC3	ZINC000000107067	O=C(COc1nsnc1N2CCOCC2)N3CCOCC3
Cc1ccccc1NC(=O)COc2cc(Cl)c(Cl)cc2Cl	ZINC000000363155	O=C(COc1ccccc1)Nc2ccccc2
CN(C)C[C@@H](O)COc3ccc(CN2CCN(c1cccc(Cl)c1)CC2)cc3	ZINC000012206532	C2CN(c1ccccc1)CCN2Cc3ccccc3
CCCc3nn2c(=N)c(=C/c1ccc(O)c(OC)c1)/c(=O)nc2s3	ZINC000000092304	N=c2c(=Cc1ccccc1)c(=O)nc3scnn23
NCC(=O)N3CCN(C(c1ccccc1)c2ccccc2)CC3	ZINC000024869140	C3CN(C(c1ccccc1)c2ccccc2)CCN3
COc3cc([C@@H]1NC(=O)N(C)C2=C1C(=O)CCC2)cc(OC)c3OC	ZINC000000067209	O=C3NC(c1ccccc1)C2=C(CCCC2=O)N3
Cn1nnnc1SCCN[C@H]3[C@H](O)C2(CCNCC2)c4ccccc34	ZINC000072148556	C(CSc1nnn[nH]1)NC3CC2(CCNCC2)c4ccccc34
CC(=O)Nc3cccc(c2cc(c1ccc(Cl)cc1Cl)no2)c3	ZINC000000076379	c3ccc(c2cc(c1ccccc1)on2)cc3
CN(C)\C=C(/C=[N+](C)C)c1cc(C(/C=[N+](C)C)=C/N(C)C)[nH]n1	ZINC000000028382	c1cn[nH]c1
COCC[N@@](CC2CCN(Cc1ccccc1OC)CC2)C3CCN(C(C)=O)CC3	ZINC000011662635	C3CC(NCC2CCN(Cc1ccccc1)CC2)CCN3
Cc2cc(C)nc(SCC(=O)c1ccc(Br)cc1)n2	ZINC000000064871	O=C(CSc1ncccn1)c2ccccc2
Cc3ccc(C(O)(C(=O)Nc1ccccn1)c2ccc(C)cc2)cc3	ZINC000000053175	O=C(Nc1ccccn1)C(c2ccccc2)c3ccccc3
Cc2cn(C(=O)c1ccccc1)c(=O)[nH]c2=O	ZINC000000011114	O=C(c1ccccc1)n2ccc(=O)[nH]c2=O
CC(=O)Nc2nc(NC(C)=O)nc(c1ccccc1C(F)(F)F)n2	ZINC000000090340	c2ccc(c1ncncn1)cc2
Cn2c(N1CCCCC1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000040793	O=c3[nH]c(=O)c2[nH]c(N1CCCCC1)nc2[nH]3
CN2CCN(Cc1ccc(N(=O)=O)s1)CC2	ZINC000000040791	C2CN(Cc1cccs1)CCN2
CN3CCN(C(=O)C2CCN(Cc1cccc(O)c1)CC2)CC3	ZINC000006379356	O=C(C2CCN(Cc1ccccc1)CC2)N3CCNCC3
Cc1nccn1CC4(CNC(=O)c3cn(C[C@@H]2CCCNC2)nn3)CC4	ZINC000067739823	O=C(NCC2(Cn1ccnc1)CC2)c4cn(CC3CCCNC3)nn4
CN3CCCN(c2nc(C)nc1CC[N@](C[C@H](O)CO)CCc12)CC3	ZINC000072435382	C3CNCCN(c2ncnc1CCNCCc12)C3
Clc1ccccc1Cn3cc2[nH]cccc2c3=O	ZINC000000003002	O=c2n(Cc1ccccc1)cc3[nH]cccc23
CCOC(=O)c3nc2c1cc(C)ccc1n(CC)c(=O)n2n3	ZINC000000004467	O=c2[nH]c1ccccc1c3ncnn23
CN(C(=O)Cc1cccs1)C3(C(=O)NC2CCCC2)CCCCC3	ZINC000000246605	O=C(Cc1cccs1)NC3(C(=O)NC2CCCC2)CCCCC3
COC[C@@H]4CCC[N@@](Cc3ccc2OCCN(C(=O)CN1CCCCC1)Cc2c3)C4	ZINC000012162051	O=C(CN1CCCCC1)N4CCOc3ccc(CN2CCCCC2)cc3C4
CCS(=O)(=O)N2CCC(NC1CCN(C(C)C)CC1)CC2	ZINC000021795316	C2CC(NC1CCNCC1)CCN2
Cc4ccc3[nH]c(=O)c(CN(C1CC1)C(=O)Nc2ccccc2)cc3c4	ZINC000000413063	O=C(Nc1ccccc1)N(Cc3cc2ccccc2[nH]c3=O)C4CC4
CNc4nc(C1CCNCC1)nc3C[N@](CCC(=O)N2CCOCC2)CCc34	ZINC000019711293	O=C(CCN3CCc2cnc(C1CCNCC1)nc2C3)N4CCOCC4
CN(C)C[C@@H](O)COc1cccc(OC[C@H](O)CN(C)C)c1	ZINC000000358423	c1ccccc1
Nc3ccc(c2nc1ccccc1s2)cc3	ZINC000000006299	c3ccc(c2nc1ccccc1s2)cc3
Cc1ccccc1CN3CCC(N2CCCC2)CC3	ZINC000004745769	C3CCN(C2CCN(Cc1ccccc1)CC2)C3
OCCN2COc1ccccc1C2=O	ZINC000000006296	O=C1NCOc2ccccc12
C[C@H](N)C(=O)N3Cc1ccccc1OC2(CCC(CN(C)C)CC2)C3	ZINC000012122677	C1CCC3(CC1)CNCc2ccccc2O3
CCOC(=O)[C@@]2(C#N)[C@@H](c1ccccc1)C(OC)(OC)C2(OC)OC	ZINC000000340800	C2CC(c1ccccc1)C2
CSc2ccc(\C=N\n1nnnc1N)cc2	ZINC000000052255	C(=Nn1cnnn1)c2ccccc2
NC(=O)N(O)[C@@H]2CCc3cc(Oc1ccccc1)ccc23	ZINC000000015062	C3Cc2ccc(Oc1ccccc1)cc2C3
Brc3ccc(NC(=O)c2cc1ccccc1c(=O)o2)cc3	ZINC000000204875	O=C(Nc1ccccc1)c3cc2ccccc2c(=O)o3
O=N(=O)c3ccc2[nH]c(c1ccccc1)cc2c3	ZINC000000024246	c3ccc(c2cc1ccccc1[nH]2)cc3
CN(C)CCCNC(=S)N(CCN(C)C)Cc3cc2cc1OCOc1cc2[nH]c3=O	ZINC000006198513	O=c3ccc2cc1OCOc1cc2[nH]3
Cc3nn(c1ccccc1)c4sc(C(=O)n2cccn2)cc34	ZINC000000042224	O=C(c3cc2cnn(c1ccccc1)c2s3)n4cccn4
COc2ccc(NC(=O)CSc1nnc(C(F)(F)F)n1C)cc2	ZINC000000040931	O=C(CSc1nnc[nH]1)Nc2ccccc2
COc2ccc(C(=O)n1ncn(C)c1=S)cc2	ZINC000000032653	O=C(c1ccccc1)n2nc[nH]c2=S
Cc2[nH]c1ccc(N(=O)=O)cc1c2CCN3C(=O)OC(C)(C)[C@]3(C)O	ZINC000000032651	O=C1OCCN1CCc2c[nH]c3ccccc23
CC(C)c2ccc(C(=O)Nc1c(C)cc(Br)cc1C)cc2	ZINC000000308781	O=C(Nc1ccccc1)c2ccccc2
Cc3cc(C)n(C(=O)CNC(=O)C(c1ccccc1)c2ccccc2)n3	ZINC000000286491	O=C(NCC(=O)n1cccn1)C(c2ccccc2)c3ccccc3
CCOC(=O)[C@@]3(c1ccccc1)NC(=O)c2c(C)c(C)sc2N3	ZINC000000034378	O=C2NC(c1ccccc1)Nc3sccc23
Cc3ccc(C(=O)COc2ccc(NC(=O)c1ccccc1)cc2)cc3	ZINC000000107882	O=C(COc2ccc(NC(=O)c1ccccc1)cc2)c3ccccc3
C[C@@]2(O)N(Cc1ccco1)C(=O)OC23CCCCC3	ZINC000000034480	O=C2OC1(CCCCC1)CN2Cc3ccco3
CC(=O)c2c(C)n(CCc1ccc(Cl)cc1)c3ccc(O)cc23	ZINC000000034482	C(Cn1ccc2ccccc12)c3ccccc3
CC3CCN(C(=O)[C@@H](C)N2CCC(CN1CCOCC1)CC2)CC3	ZINC000051958165	O=C(CN2CCC(CN1CCOCC1)CC2)N3CCCCC3
Cn2c(c1ccccc1)nnc2S(C)(=O)=O	ZINC000000024658	c2ccc(c1nnc[nH]1)cc2
CN(CCO)CC2c1ccccc1C(C[N@@](C)CCO)c3ccccc23	ZINC000000877750	C2c1ccccc1Cc3ccccc23
CC[N@]1C[C@@H]2[C@H](C1)[C@@](CO)(CCO)N[C@@H]2c4cc(OC)c3OCOc3c4	ZINC000065435663	C4Oc3ccc(C2NCC1CNCC12)cc3O4
COc4ccc(OC)c(c3ccc(C(=O)N(C)C1CCN(C)CC1)c(N2CCN(C)CC2)n3)c4	ZINC000012098858	O=C(NC1CCNCC1)c3ccc(c2ccccc2)nc3N4CCNCC4
Cc1ccc(F)cc1NC(=O)CSc2nnnn2C	ZINC000000031456	O=C(CSc1nnn[nH]1)Nc2ccccc2
CN(C(C)=O)c2ccc(NC(=O)N1CCOCC1)cc2	ZINC000000031699	O=C(Nc1ccccc1)N2CCOCC2
O=C4C[C@H](N3CCC(C2CCN([C@H]1CC(=O)NC1=O)CC2)CC3)C(=O)N4	ZINC000012343592	O=C4CC(N3CCC(C2CCN(C1CC(=O)NC1=O)CC2)CC3)C(=O)N4
CCOC(=O)c2cccc(NC(=O)N1CCOCC1)c2	ZINC000000031697	O=C(Nc1ccccc1)N2CCOCC2
CCOc2cc(C(=O)Nc1cc(C)on1)cc(OCC)c2OCC	ZINC000000031695	O=C(Nc1ccon1)c2ccccc2
Clc3ccc(SCc2ccc(C(=O)N1CCOCC1)cc2)cc3	ZINC000000343169	O=C(N1CCOCC1)c3ccc(CSc2ccccc2)cc3
O=c1ccc(=O)n1Cc4ccc[n+](CCC[n+]3cccc(Cn2c(=O)ccc2=O)c3)c4	ZINC000001703760	O=c1ccc(=O)n1Cc4ccc[n+](CCC[n+]3cccc(Cn2c(=O)ccc2=O)c3)c4
COc3ccc(c2nc(c1ccc(Br)cc1)cs2)cc3	ZINC000000172045	c3ccc(c2csc(c1ccccc1)n2)cc3
Brc3ccc(c2ccc(C=c1[nH]c(=S)[nH]c1=O)o2)cc3	ZINC000000136583	O=c1[nH]c(=S)[nH]c1=Cc3ccc(c2ccccc2)o3
CC(C)(C)CN3CCC[C@](O)(CN2CCC(N1CCCC1)CC2)C3=O	ZINC000011934079	O=C1NCCCC1CN3CCC(N2CCCC2)CC3
S=c2[nH]c1ccccc1n2Cc3ccccn3	ZINC000000024819	S=c2[nH]c1ccccc1n2Cc3ccccn3
CC(=O)Oc1cccccc1=O	ZINC000000003736	O=c1cccccc1
NC[C@H](CC(O)=O)Cc1ccco1	ZINC000000008912	c1ccoc1
C[N@]3C[C@@H](CN1CCCCC1)[C@H](O)[C@H](c2ccccc2)C3	ZINC000005699167	C3CCN(CC2CNCC(c1ccccc1)C2)CC3
COc3ccc(CN[C@H]1[C@H](O)[C@@H](N(C)CCN(C)C)[C@@H]2OC[C@H]1O2)cc3	ZINC000020463934	C2CC(NCc1ccccc1)C3COC2O3
Cc2cc(C)c(CSC1=NCCN1)c(C)c2CSC3=NCCN3	ZINC000000144930	C3CN=C(SCc2cccc(CSC1=NCCN1)c2)N3
O=C(NCc1cccnc1)[C@@H]2CC2(c3ccccc3)c4ccccc4	ZINC000000049201	O=C(NCc1cccnc1)C2CC2(c3ccccc3)c4ccccc4
CN(C)c3ccc(NC(=O)C[C@H]2Nc1ccccc1NC2=O)cc3	ZINC000000046569	O=C(CC2Nc1ccccc1NC2=O)Nc3ccccc3
C1CCC2(CC1)NCCc3c2[nH]c4ccccc34	ZINC000000083421	C1CCC2(CC1)NCCc3c2[nH]c4ccccc34
COc3ccc(NC(=O)C(C#N)=C1NC(C)(C)Cc2ccccc12)cc3	ZINC000000343615	O=C(Nc1ccccc1)C=C2NCCc3ccccc23
CC2(C)CN=C(NCCNC1=NCC(C)(C)S1)S2	ZINC000004207778	C(CNC1=NCCS1)NC2=NCCS2
Brc1ccccc1OCC(=O)NCc2ccco2	ZINC000000037978	O=C(COc1ccccc1)NCc2ccco2
Nc2ccc1N=c3n(Cc1c2)c(=O)c4ccccc34	ZINC000000003827	O=c3n2Cc1ccccc1N=c2c4ccccc34
Fc4cccc([C@H]3CC(=O)c2cc1OCOc1cc2N3)c4	ZINC000000023387	O=C3CC(c1ccccc1)Nc4cc2OCOc2cc34
Cc3ccc([C@@H](CC(=O)Nc1ccccc1C)c2ccccc2)c(O)c3	ZINC000000302451	O=C(CC(c1ccccc1)c2ccccc2)Nc3ccccc3
C[C@@H](NC(=S)Nc1ccc(Br)cn1)c2ccccc2	ZINC000000008820	S=C(NCc1ccccc1)Nc2ccccn2
CCC(=O)NC(Nc1ccc(O)cc1)(C(F)(F)F)C(F)(F)F	ZINC000000088252	c1ccccc1
S=c1[nH]ccn1Cc2ccco2	ZINC000000024727	S=c1[nH]ccn1Cc2ccco2
CCOC(=O)Cc2csc(NC(=O)c1ccc(C)c(N(=O)=O)c1)n2	ZINC000000175240	O=C(Nc1nccs1)c2ccccc2
Nc2nnc(Cc1ccc(N(=O)=O)cc1)s2	ZINC000000052712	C(c1ccccc1)c2nncs2
COc3ccc2oc(C(=O)c1ccc(F)cc1)c(NC(C)=O)c2c3	ZINC000000054946	O=C(c1ccccc1)c3cc2ccccc2o3
COc2cccc(CNc1ccc(F)c(N(=O)=O)c1)c2O	ZINC000000041324	C(Nc1ccccc1)c2ccccc2
C[n+]4ccc(c3nc2sc(c1cc[n+](C)cc1)nc2s3)cc4	ZINC000002519611	c4cc(c3nc2sc(c1ccncc1)nc2s3)ccn4
Cc5ccc4c3[C@@H]([C@@H]1CCC=CC1)C2=C(CCCC2=O)Nc3ccc4n5	ZINC000000140601	O=C1CCCC3=C1C(C2CCC=CC2)c4c(N3)ccc5ncccc45
CCOc3cc2occ(c1ccccc1Cl)c(=S)c2cc3CC	ZINC000000311607	S=c2c(c1ccccc1)coc3ccccc23
CCc2cccc3Oc1ccccc1S(=O)(=O)c23	ZINC000000004918	O=S3(=O)c1ccccc1Oc2ccccc23
CCSC1=NCC(=O)N1c2ccccc2	ZINC000000022380	O=C1CN=CN1c2ccccc2
Cc2cc(NC(=O)NC(=O)c1ccc(Cl)cc1Cl)n[nH]2	ZINC000000033745	O=C(NC(=O)c1ccccc1)Nc2cc[nH]n2
COC(=O)c3cc(=O)n2c(c1ccccc1)nnc2s3	ZINC000000124309	O=c2ccsc3nnc(c1ccccc1)n23
CCN4CCN(C3CCN(Cc2cc1ccc(Cl)cc1n(CC(=O)OC)c2=O)CC3)CC4	ZINC000023362241	O=c2[nH]c1ccccc1cc2CN4CCC(N3CCNCC3)CC4
CN(C)CCSc1nnc(SCCN(C)C)s1	ZINC000005342221	c1nncs1
Clc2ccc(NC(=O)Nc1snnc1Cl)cc2	ZINC000000047781	O=C(Nc1ccccc1)Nc2cnns2
Cc3cc(C)cc(OCC(=O)Nc2nc(c1ccccc1)cs2)c3	ZINC000000037973	O=C(COc1ccccc1)Nc3nc(c2ccccc2)cs3
COc2c1ccoc1c(OC)c3oc(CSC)cc(=O)c23	ZINC000000002174	O=c2ccoc3cc1occc1cc23
Cc3ccc([C@H]2COc1cc(O)c(O)cc1C2)cc3	ZINC000000002772	C2Oc1ccccc1CC2c3ccccc3
COC(=O)c3cnn4c(NC1CCCCC1)c(c2cccs2)[nH]c34	ZINC000000259184	C4CCC(Nc2c(c1cccs1)[nH]c3ccnn23)CC4
COc1ccc(C)cc1NC(=O)Cn3nnc(c2ccncc2)n3	ZINC000000378574	O=C(Cn2nnc(c1ccncc1)n2)Nc3ccccc3
CCN1C(=O)N(CCN(C)C)C(=O)C14CCN(Cc3cc2OCOc2cc3Cl)CC4	ZINC000014535722	O=C4NC(=O)C3(CCN(Cc2ccc1OCOc1c2)CC3)N4
Clc4ccc3oc1ccccc1nc(N2CCNCC2)c3c4	ZINC000000000931	C4CN(c2nc1ccccc1oc3ccccc23)CCN4
OC(=COc1ccc(F)cc1)n2nnc3ccccc23	ZINC000000049333	O(C=Cn1nnc2ccccc12)c3ccccc3
Cc2onc(c1ccccc1)c2c3ccc(S(N)(=O)=O)cc3	ZINC000000006694	c3ccc(c1conc1c2ccccc2)cc3
C[C@H](N(O)C(N)=O)c2cc1ccccc1s2	ZINC000000000850	c2ccc1sccc1c2
CN3CCN(Nc2ncnc(NCCN1CCCCC1)c2N)CC3	ZINC000040756227	C3CCN(CCNc2cc(NN1CCNCC1)ncn2)CC3
CCOC(=O)CC[C@H]1OC(=O)C(OC)=C1c2ccccc2	ZINC000000005196	O=C2OCC(c1ccccc1)=C2
CSc1nc(N)nc(SCC(=O)C(C)(C)C)c1C#N	ZINC000000058471	c1cncnc1
COc4ccc3O[C@]1(CCCN(C)CC1)C[N@@](C[C@@H]2CCOC2)Cc3c4	ZINC000012365608	C1CNCCC4(C1)CN(CC2CCOC2)Cc3ccccc3O4
C[C@@H](N1C(=O)CC[C@]1(C)C(=O)NC2CCCCCC2)c3ccccc3	ZINC000000218626	O=C2CCC(C(=O)NC1CCCCCC1)N2Cc3ccccc3
C[N@]3CCCN(c2cnn(C[C@@H]1CCNC1)c(=O)c2)CC3	ZINC000020535832	O=c2cc(N1CCCNCC1)cnn2CC3CCNC3
Cc2sc(NC(=O)\C=C\c1ccco1)c(C(N)=O)c2C	ZINC000000027711	O=C(Nc1cccs1)C=Cc2ccco2
ON2C1=NCCN1S(=O)(=O)c3ccccc23	ZINC000000019372	O=S3(=O)N1CCN=C1Nc2ccccc23
O=C(N1CCCc2ccccc12)c4ccc3OCOc3c4	ZINC000000027719	O=C(N1CCCc2ccccc12)c4ccc3OCOc3c4
CN(C)CCCNc1nc3cccc2nc(C)nc(n1)n23	ZINC000001589314	c1cc2ncnc3ncnc(c1)n23
Cc2ccc(S(=O)(=O)NCc1nnc(N)s1)cc2	ZINC000000050252	O=S(=O)(NCc1nncs1)c2ccccc2
Cc1cccc2ncc(C(N)=O)c(=O)n12	ZINC000000010761	O=c1ccnc2ccccn12
NCC(=O)N1CCOCCOCCN(C(=O)CN)CCOCCOCC1	ZINC000004936615	C1COCCOCCNCCOCCOCCN1
COc3ccc(OCC1=NCCc2ccccc12)cc3	ZINC000000001674	C3Cc1ccccc1C(COc2ccccc2)=N3
CN(C)CCn2c1CC[N@](C)Cc1c3ccccc23	ZINC000003600656	C3Cc2[nH]c1ccccc1c2CN3
COc1ccccc1N4CCN(C2[C@H]3CCC[C@@H]2CNC3)CC4	ZINC000019571188	C1CC2CNCC(C1)C2N4CCN(c3ccccc3)CC4
Brc2csc(Cc1c[nH]cn1)c2	ZINC000000022768	C(c1c[nH]cn1)c2cccs2
Cn4c(c1ccccc1)nn(CN2CCC3(CC2)OCCO3)c4=S	ZINC000000054233	S=c2[nH]c(c1ccccc1)nn2CN3CCC4(CC3)OCCO4
O=c2oc(c1ccco1)n/c2=C/c4cccc(OCc3ccccc3)c4	ZINC000000063453	O=c2oc(c1ccco1)nc2=Cc4cccc(OCc3ccccc3)c4
CN4CCN(C(=O)[C@]13CCC[C@H]1[N@@](Cc2ccccn2)CC=CC3)CC4	ZINC000012135536	O=C(N1CCNCC1)C24CCCC2N(Cc3ccccn3)CC=CC4
Cn2cnc3c(NC1CCCC1)ncnc23	ZINC000000005203	C3CCC(Nc1ncnc2[nH]cnc12)C3
ClC(Cl)(Cl)[C@@H](NC(=O)Nc1ccccc1)c2ccccc2	ZINC000000245775	O=C(NCc1ccccc1)Nc2ccccc2
Nc3nncc(C12CCN(CC1)C2)n3	ZINC000000005200	C2CC3(c1cnncn1)CCN2C3
COc3ccc(S(=O)(=O)N[C@H]1CCc2ccccc12)cc3OC	ZINC000000021702	O=S(=O)(NC1CCc2ccccc12)c3ccccc3
COc4cc1CCN(C)Cc1c(c3c(O)c(OC)cc2CC[N@](C)Cc23)c4O	ZINC000001719347	C4Cc3cccc(c2cccc1CCNCc12)c3CN4
C[C@@H](O)CN1CCN(CCN(C[C@H](C)O)C[C@H](C)O)CC1	ZINC000000393843	C1CNCCN1
CN(C)CCNC(=O)CC[C@H]2C[N@](Cc1ccccc1)CC[C@H]2N3CCN(C)CC3	ZINC000023359120	C3CN(C2CCN(Cc1ccccc1)CC2)CCN3
CN4CCN(Cc3nnc(C2CCN(C1CCOCC1)CC2)n3C)CC4	ZINC000092066471	C4CN(Cc3nnc(C2CCN(C1CCOCC1)CC2)[nH]3)CCN4
COc2ccc(CCC(=O)Nc1ccc(CC#N)cc1)cc2	ZINC000000037209	O=C(CCc1ccccc1)Nc2ccccc2
COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc2ccc(C)cc2	ZINC000000278501	O=C(COc1ccccc1)Nc2ccccc2
Clc1ccccc1OCC(=O)Nc2ccc(CC#N)cc2	ZINC000000037203	O=C(COc1ccccc1)Nc2ccccc2
CCOc3ccc(C(=O)N(CC[N@]1CCCC[C@@H]1C)CCC(=O)N2CCNCC2)cc3	ZINC000035422030	O=C(CCN(CCN1CCCCC1)C(=O)c2ccccc2)N3CCNCC3
O=c2oc(c1ccccc1)c/c2=C/c4ccc3OCOc3c4	ZINC000000044154	O=c2oc(c1ccccc1)cc2=Cc4ccc3OCOc3c4
C[C@@H](\C=C\c1ccc(C)o1)N(O)C(N)=O	ZINC000000010352	c1ccoc1
COC(=O)[C@@H](C)N(C(=O)c1ccc(Cl)cc1)c2c(C)cccc2C	ZINC000000297731	O=C(Nc1ccccc1)c2ccccc2
Clc3ccc(SCC(=O)Nc2ccc1OCOc1c2)cc3	ZINC000000037680	O=C(CSc1ccccc1)Nc3ccc2OCOc2c3
O=C(Nc1nncs1)c3cccc(S(=O)(=O)N2CCCC2)c3	ZINC000000247099	O=C(Nc1nncs1)c3cccc(S(=O)(=O)N2CCCC2)c3
CCSC(=O)c1cccc(C(=O)SCC)c1	ZINC000000001324	c1ccccc1
Cc1nccn1CC4(O)CCN(C(=O)C3CN(Cc2ccccc2)C3)CC4	ZINC000019287840	O=C(C2CN(Cc1ccccc1)C2)N4CCC(Cn3ccnc3)CC4
OCC(CO)NCc3cccc(OC[C@@H](O)C[N@]2CCc1ccccc1C2)c3	ZINC000011950441	C(COc1ccccc1)CN3CCc2ccccc2C3
COc2ccc([C@H](OC(C)=O)C#N)c(OCc1ccccc1)c2OC	ZINC000000036424	C(Oc1ccccc1)c2ccccc2
CN(C)CCNc2nnc(NCCN(C)C)c3cc1ccccc1cc23	ZINC000001608070	c3ccc2cc1cnncc1cc2c3
CCOC(=O)[C@H](C)Oc2ccc1c(C)c(CCC(C)C)c(=O)oc1c2	ZINC000000217529	O=c2ccc1ccccc1o2
COCCN4CCC(C[N@@](C)Cc2c(C(=O)N1CCCCC1)nc3sccn23)CC4	ZINC000011936134	O=C(N1CCCCC1)c3nc2sccn2c3CNCC4CCNCC4
O=C(Nc1nn[nH]n1)c3cc(c2cccs2)on3	ZINC000000020838	O=C(Nc1nn[nH]n1)c3cc(c2cccs2)on3
CN2C(=O)N[C@@H](c1ccc(Br)cc1)C3=C2CCCC3=O	ZINC000000067231	O=C3NC(c1ccccc1)C2=C(CCCC2=O)N3
O=C(NCc2nc(c1ncccn1)no2)[C@@H]4CC3(CCNCC3)CN4	ZINC000072133884	O=C(NCc2nc(c1ncccn1)no2)C4CC3(CCNCC3)CN4
C[N@]1CCC3=C(C1)c2nsnc2SC3	ZINC000000021235	C1CC3=C(CN1)c2nsnc2SC3
CN(C)CCCNCC(=O)Nc1cccc(N(=O)=O)c1C	ZINC000002649498	c1ccccc1
NCc4cn(C3CCN(Cc1cccn1c2ncccn2)CC3)nn4	ZINC000023478458	C3CN(Cc1cccn1c2ncccn2)CCC3n4ccnn4
Cc3csc(Nc2nc1ccccc1[nH]2)n3	ZINC000000004640	N(c2nc1ccccc1[nH]2)c3nccs3
Cn2cc(N(=O)=O)c(C(=O)Nc1ccccc1)n2	ZINC000000040471	O=C(Nc1ccccc1)c2cc[nH]n2
CCN(CC)C[C@H](O)CNc3nccc4c(C)c2[nH]c1ccncc1c2cc34	ZINC000005139348	c4cc3cc2[nH]c1ccncc1c2cc3cn4
Cc2ccc(NC(=O)Nc1ccc(Cl)cc1)cc2Br	ZINC000000065688	O=C(Nc1ccccc1)Nc2ccccc2
Cc3ccnc4n(C1CC1)c2ncccc2c(=O)[nH]c34	ZINC000000004778	O=c3[nH]c1cccnc1n(C2CC2)c4ncccc34
O=N(=O)c1ccc2c(c1)[nH]c(=O)c3nncn23	ZINC000000007118	O=c2[nH]c1ccccc1n3cnnc23
COc4ccc(OCCNCCn2nc([C@@H]1CCNC1)c3nccnc23)cc4	ZINC000019556874	C(COc1ccccc1)NCCn3nc(C2CCNC2)c4nccnc34
CN(C)CC(=O)Nc3ccc2[C@H]1CNC[C@H](C1)Cn2c3=O	ZINC000005413549	O=c3cccc2C1CNCC(C1)Cn23
Clc2cccc3CN(C1=NCCN1)Cc23	ZINC000000006515	C3CN=C(N2Cc1ccccc1C2)N3
COc1ccccc1N(CCNCCCN2CCOCC2)S(C)(=O)=O	ZINC000011117781	C(CNCCNc1ccccc1)CN2CCOCC2
CC(C)NC(=O)[C@H]1C[N@]2CC[C@@H]1C[C@@H]2Cn3cc(CN(C)C)nn3	ZINC000008297959	C1CN2CCC1CC2Cn3ccnn3
Fc1cccc(F)c1C(=O)Nc4ccc(c3nc2ccccc2[nH]3)cc4	ZINC000000067304	O=C(Nc3ccc(c2nc1ccccc1[nH]2)cc3)c4ccccc4
C=CCn5nc(C(=O)N1CCOCC1)c4C[C@H](NC3CCN(Cc2ccccc2)CC3)CCc45	ZINC000014536079	O=C(N1CCOCC1)c5n[nH]c4CCC(NC3CCN(Cc2ccccc2)CC3)Cc45
Cc1noc(C)c1COc3ccc2c(C)cc(=O)oc2c3	ZINC000000038245	O=c3ccc2ccc(OCc1cnoc1)cc2o3
OC[C@@H]3CC[C@@H](n2ccc(NC(=O)c1ccccc1)nc2=O)O3	ZINC000000042784	O=C(Nc2ccn(C1CCCO1)c(=O)n2)c3ccccc3
CCN3CCN(CCNC(=O)CC2CCN(c1ccnc(NC)n1)CC2)CC3	ZINC000065282096	O=C(CC2CCN(c1ccncn1)CC2)NCCN3CCNCC3
CN(C#N)c3nc(N1CCOCC1)nc(N2CCOCC2)n3	ZINC000000110876	C3CN(c2ncnc(N1CCOCC1)n2)CCO3
O=C(NCc2cn1ccsc1n2)[C@@]35CNC[C@@H]3C[N@](C4CCCC4)C5	ZINC000065426458	O=C(NCc2cn1ccsc1n2)C35CNCC3CN(C4CCCC4)C5
NC(=O)c2cn(Cc1c(F)cccc1F)nn2	ZINC000000007782	C(c1ccccc1)n2ccnn2
Clc3ccc(CCNC(=O)c2ccc1SCC(=O)Nc1c2)cc3	ZINC000000217045	O=C3CSc2ccc(C(=O)NCCc1ccccc1)cc2N3
NCCOc2cc(N1CCC(N)CC1)cc3sc(C(N)=O)c(N)c23	ZINC000006745115	C3CCN(c2ccc1ccsc1c2)CC3
CN(C)CCN2C[C@@H](C(=O)N1CCN(CCCCO)CC1)CCC2=O	ZINC000011839360	O=C2CCC(C(=O)N1CCNCC1)CN2
CN(C)CCNC(=O)[C@@H]3C[C@H](CN1CCN(C)CC1)CN(Cc2nccn2C)C3	ZINC000023353780	C3CC(CN1CCNCC1)CN(Cc2ncc[nH]2)C3
Cc2noc(COc1ccccc1OCC(N)=O)n2	ZINC000000031992	C(Oc1ccccc1)c2ncno2
COc4ccc3nc(NC(=O)[C@H]1C[C@@H]1c2ccccc2)sc3c4	ZINC000000028441	O=C(Nc2nc1ccccc1s2)C3CC3c4ccccc4
CC(=O)c4ccc(OC(=O)C2c1ccccc1Oc3ccccc23)cc4	ZINC000000292030	O=C(Oc1ccccc1)C3c2ccccc2Oc4ccccc34
NC(=O)c2ccc[n+](CCCCC[n+]1cccc(C(N)=O)c1)c2	ZINC000001955639	C(CC[n+]1ccccc1)CC[n+]2ccccc2
CC[C@@H]3CN(C(=O)c2cc(CN1CCC(O)CC1)on2)CC[N@]3C(C)C	ZINC000067872890	O=C(N1CCNCC1)c3cc(CN2CCCCC2)on3
O=S(=O)(NCc1cccnc1)c2ccccc2	ZINC000000029145	O=S(=O)(NCc1cccnc1)c2ccccc2
CC3(C)Cc1ccccc1C(N2CCOCC2)=N3	ZINC000000051827	C3CN(C1=NCCc2ccccc12)CCO3
O=CNc1ccccc1Oc2ccccc2	ZINC000000028148	O(c1ccccc1)c2ccccc2
Ic2ccc(NC(=O)CC1CCCCC1)cc2	ZINC000000317294	O=C(CC1CCCCC1)Nc2ccccc2
O=N(=O)c4ccc(/C=C/C3=NN(c1ccccc1)[C@H](c2ccco2)C3)o4	ZINC000000190438	C3C(c1ccco1)N(c2ccccc2)N=C3C=Cc4ccco4
C[C@@H]1CCC[C@@H](C)N1C(=O)c3cc2ccccc2oc3=O	ZINC000000035694	O=C(N1CCCCC1)c3cc2ccccc2oc3=O
Nc1nonc1NC(=O)CSc2cccc3ccccc23	ZINC000000043554	O=C(CSc1cccc2ccccc12)Nc3cnon3
CCN(C)C(=O)Oc1nsnc1c2c(Cl)cccc2Cl	ZINC000000006647	c2ccc(c1cnsn1)cc2
Clc1ccccc1c4nnc5c3cnn(c2ccccc2)c3ncn45	ZINC000000206064	c5ccc(c3nnc4c2cnn(c1ccccc1)c2ncn34)cc5
NC12CC3(F)CC(F)(C1)CC(F)(C2)C3	ZINC000000007410	C1C2CC3CC1CC(C2)C3
NC(=N)SC[C@H]1OCO[C@H]1[C@H]2OCO[C@H]2CSC(N)=N	ZINC000017005388	C2OCC(C1COCO1)O2
CCC[N@@](C)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC2CCOCC2	ZINC000020465669	C2COC(CNC1CCOCC1)C2
COc4cccc(C(=O)NN2c1ccccc1CCc3ccccc23)c4	ZINC000000348149	O=C(NN2c1ccccc1CCc3ccccc23)c4ccccc4
O=C(Cn2cnc1ccccc1c2=O)N4CCN(c3ccccc3)CC4	ZINC000000106452	O=C(Cn2cnc1ccccc1c2=O)N4CCN(c3ccccc3)CC4
Cc1occc1c3nnc(c2ccc(N(=O)=O)cc2Cl)o3	ZINC000000031427	c3ccc(c2nnc(c1ccoc1)o2)cc3
CCOC(=O)C1=C(C)NC(=O)C[C@@H]1c2ccc(Cl)cc2Cl	ZINC000000031420	O=C2CC(c1ccccc1)C=CN2
C[N@]1CCc3c(Cl)ccc2CCC[C@@H](C1)c23	ZINC000000004783	C1CC2CNCCc3cccc(C1)c23
CN(C)CCN(C)C(=O)c2cccc3c(N)c1ccccc1nc23	ZINC000005957777	c3ccc2nc1ccccc1cc2c3
Cc2ccc(S(=O)(=O)NCCC(=O)N1CCCCC1)cc2	ZINC000000042124	O=C(CCNS(=O)(=O)c1ccccc1)N2CCCCC2
COc1ccccc1[C@@H]3[C@@H](C)[C@](C)(O)Oc4cc2OCOc2cc34	ZINC000000044802	C4CC(c1ccccc1)c3cc2OCOc2cc3O4
NC(=O)c3c(c1ccccc1)c2ccccc2c3=O	ZINC000000017343	O=c2cc(c1ccccc1)c3ccccc23
O=C2N(C/C=C/c1ccccc1)CCN2c3cccnc3	ZINC000000003699	O=C2N(CC=Cc1ccccc1)CCN2c3cccnc3
COC[C@@H]4CCCN(Cc2c(C(=O)N1CCC[N@@](C)CC1)nc3sccn23)C4	ZINC000019939733	O=C(N1CCCNCC1)c3nc2sccn2c3CN4CCCCC4
Fc3cccc(NC(=O)CCS(=O)(=O)c1cccc2nonc12)c3	ZINC000000212818	O=C(CCS(=O)(=O)c1cccc2nonc12)Nc3ccccc3
Cc3nc2c(c1ccc(Cl)cc1)c(C)nn2c(N)c3c4ccccc4	ZINC000000038069	c4ccc(c3cnc2c(c1ccccc1)cnn2c3)cc4
CCNC(=O)c3c(NC(=O)c1ccccc1C)sc2CCCCc23	ZINC000000372872	O=C(Nc2cc1CCCCc1s2)c3ccccc3
Oc1ccccc1[C@@H](Nn2cnnc2)c3ccc(Br)cc3	ZINC000000041786	N(C(c1ccccc1)c2ccccc2)n3cnnc3
COc2ccc(C(=O)COc1ccc(Br)cc1)c(O)c2	ZINC000000041787	O=C(COc1ccccc1)c2ccccc2
OCC3(c1ccccc1)C(=O)c2ccccc2C3=O	ZINC000000001853	O=C2C(c1ccccc1)C(=O)c3ccccc23
Cc3ccc(n1nnnc1SCC(=O)N2CCOCC2)c(C)c3	ZINC000000146079	O=C(CSc1nnnn1c2ccccc2)N3CCOCC3
COC(=O)c3ccc2nc(NC(=O)CN1C(=O)CCC1=O)sc2c3	ZINC000000033070	O=C(CN1C(=O)CCC1=O)Nc3nc2ccccc2s3
Cc3ccc(C(=O)N1CCCc2ccccc12)cc3Br	ZINC000000045952	O=C(N1CCCc2ccccc12)c3ccccc3
C[C@H](NC(=O)c1ccc(C)c(Br)c1)c2ccccc2	ZINC000000045956	O=C(NCc1ccccc1)c2ccccc2
CC(=O)c2cccc(NC(=O)COc1ccc(Br)cc1)c2	ZINC000000045223	O=C(COc1ccccc1)Nc2ccccc2
CCc2cc(C(=O)Cc1nc(C)cs1)c(O)cc2O	ZINC000000046553	O=C(Cc1nccs1)c2ccccc2
COc4cccc(C(=O)Nc3ccc2c(Cc1ccccc12)c3)c4OC	ZINC000000384148	O=C(Nc3ccc2c(Cc1ccccc12)c3)c4ccccc4
COc2ccc1sc(C(N)=O)c(OC(C)C)c1c2	ZINC000000005745	c2ccc1sccc1c2
CN(C)CCNC(=O)C[C@@H]2O[C@H](CNCc1ccccn1)[C@@H](O)[C@H]2O	ZINC000008627195	C2COC(CNCc1ccccn1)C2
CON[C@H]1COc2cc(OC)cc(OC)c12	ZINC000000017230	C2Cc1ccccc1O2
C5CN=C(c4ccc(c3cn(c2ccc(C1=NCCN1)cc2)nn3)cc4)N5	ZINC000045285957	C5CN=C(c4ccc(c3cn(c2ccc(C1=NCCN1)cc2)nn3)cc4)N5
COc2cc(C)c(Oc1cc(C)cc(O)c1O)c(O)c2	ZINC000000003968	O(c1ccccc1)c2ccccc2
CN(C)CC(=O)Nc4ccc3[C@@H]2C[C@@H](C[N@](C1CCN(C(C)=O)CC1)C2)Cn3c4=O	ZINC000004259185	O=c4cccc3C2CC(CN(C1CCNCC1)C2)Cn34
CN(C)C(=O)CN(C#N)c1nc(Cl)nc(N(C)C)n1	ZINC000000050069	c1ncncn1
CNCC(=O)Nc2ccc(NC(=O)CNC)c3c(=O)c1ccccc1c(=O)c23	ZINC000005996294	O=c2c1ccccc1c(=O)c3ccccc23
C[C@@H](Cc1ccccn1)N4CCC(N3CCC(C(=O)NCc2ccccn2)CC3)CC4	ZINC000011821410	O=C(NCc1ccccn1)C4CCN(C3CCN(CCc2ccccn2)CC3)CC4
Cc2nc1ccccc1nc2CSc4nnc(c3ccccc3)n4C	ZINC000000109306	C(Sc2nnc(c1ccccc1)[nH]2)c4cnc3ccccc3n4
Cn2c(=O)n(C)c(=O)n(CC(=O)N1CCCCC1)c2=O	ZINC000000032425	O=C(Cn1c(=O)[nH]c(=O)[nH]c1=O)N2CCCCC2
CCn2c(=O)c4cccc3c(S(=O)(=O)NC1CCCC1)ccc2c34	ZINC000000079052	O=c2[nH]c3ccc(S(=O)(=O)NC1CCCC1)c4cccc2c34
CN(C)C[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N2CCN(C)CC2	ZINC000020465197	C2CN(C1CCOC1)CCN2
C(Sc1ncnc2ccccc12)c3ccco3	ZINC000000024750	C(Sc1ncnc2ccccc12)c3ccco3
CC(C)C(=O)Nc2ccn([C@H]1C[C@H](O)[C@@H](CO)O1)c(=O)n2	ZINC000000057377	O=c1ncccn1C2CCCO2
COc3cc([C@@H]2NC(=O)c1ccccc1N2)cc(Br)c3O	ZINC000000146674	O=C2NC(c1ccccc1)Nc3ccccc23
Cc4nc3c(=O)n(c1ccccc1)c2n(C)c(=O)n(C)c(=O)c2c3o4	ZINC000000088260	O=c1[nH]c(=O)c4c([nH]1)n(c2ccccc2)c(=O)c3ncoc34
CCOC(=O)c2csc(CS(=O)(=O)Cc1ccco1)n2	ZINC000000125400	O=S(=O)(Cc1ccco1)Cc2nccs2
Cc2nnc3n(N)c(=O)c(CC(=O)c1ccc(F)cc1)nn23	ZINC000000408326	O=C(Cc2nn1cnnc1[nH]c2=O)c3ccccc3
CN4CCC(N[C@@H]1CC[C@@H]1NS(=O)(=O)c3ccc2OCCOc2c3)CC4	ZINC000072410920	O=S(=O)(NC1CCC1NC2CCNCC2)c4ccc3OCCOc3c4
O=C(C2c1ccccc1Oc3ccccc23)N4CCCc5ccccc45	ZINC000000061374	O=C(C2c1ccccc1Oc3ccccc23)N4CCCc5ccccc45
CCCC2=C(C(=O)OCC)[C@@H](c1cc(OC)ccc1OC)NC(=O)N2	ZINC000000124311	O=C2NC=CC(c1ccccc1)N2
COc2ccc(C(=O)NCC(=O)c1ccc(Br)cc1)cc2	ZINC000000146813	O=C(CNC(=O)c1ccccc1)c2ccccc2
Cc4ccc(c2nn(CC(=O)N1CCCC1)c(=O)c3ccccc23)cc4	ZINC000000111608	O=C(Cn3nc(c1ccccc1)c2ccccc2c3=O)N4CCCC4
O=C(NC(=S)NC1CCCCCC1)C=Cc3ccc2OCOc2c3	ZINC000000146254	O=C(NC(=S)NC1CCCCCC1)C=Cc3ccc2OCOc2c3
N[C@@H]3CSc2[nH]c1ccccc1c2C3	ZINC000000012148	C3CSc2[nH]c1ccccc1c2C3
O=C3CC(c1ccccc1)=Nc2ccccc2N3C(=O)c4ccccc4	ZINC000000046950	O=C3CC(c1ccccc1)=Nc2ccccc2N3C(=O)c4ccccc4
CN4CCN(c1ncccc1CNC[C@@H]3CNc2ccnn2C3)CC4	ZINC000058316920	C4CN(c1ncccc1CNCC3CNc2ccnn2C3)CCN4
Cc3ccc2nc(Nc1ccccc1)c(C=O)c(=O)n2c3	ZINC000000045586	O=c2cc(Nc1ccccc1)nc3ccccn23
CN(C)CCN(C[C@@H]1CCCO1)c3cc(C2CCNCC2)nc(C)n3	ZINC000039445371	C3COC(CNc2cc(C1CCNCC1)ncn2)C3
COc2ccc(OC[C@@H](O)CN1CCC(O)CC1)c(C[N@@](C)CC(C)=C)c2	ZINC000012313949	C2CCN(CCCOc1ccccc1)CC2
CC2(C)CC[C@]1(C)CCC(C)(C)N=C1N2	ZINC000000057627	C2CNC1=NCCCC1C2
CCOC(=O)c2nn(c1cc(Cl)cc(Cl)c1)c(=O)cc2Cl	ZINC000000170193	O=c1cccnn1c2ccccc2
CC(=O)Nc3c(Cl)cc(n2c(=O)c1ccccc1c2=O)cc3Cl	ZINC000000273711	O=c2n(c1ccccc1)c(=O)c3ccccc23
O[C@]3(CC(=O)c1ccc(N(=O)=O)cc1)C(=O)Nc2ccc(Cl)cc23	ZINC000000085924	O=C(CC1C(=O)Nc2ccccc12)c3ccccc3
COc3ccc(C(=O)Nn2cnc1ccccc1c2=O)c(OC)c3	ZINC000000183353	O=C(Nn2cnc1ccccc1c2=O)c3ccccc3
CCOc3ccc(NC(=S)NCCc1c[nH]c2ccccc12)cc3	ZINC000000112424	S=C(NCCc1c[nH]c2ccccc12)Nc3ccccc3
C5CN=C(c4ccc(c3cc2cc(C1=NCCN1)ccc2o3)cc4)N5	ZINC000006536326	C5CN=C(c4ccc(c3cc2cc(C1=NCCN1)ccc2o3)cc4)N5
CCN(CC)C(=O)c1ccc(C(=O)N(CC)CC)cc1	ZINC000000029544	c1ccccc1
C[N@]1CCC[C@@H]1C(=O)N[C@@H]4CCCN(c3cc(N2CCOCC2)ncn3)C4	ZINC000112507898	O=C(NC3CCCN(c2cc(N1CCOCC1)ncn2)C3)C4CCCN4
Cc2ccc(NC(=O)c1cccc(N(=O)=O)c1C)c(Br)c2	ZINC000000068134	O=C(Nc1ccccc1)c2ccccc2
Cc3cccc(NC(=O)[C@@H](Sc1ccccc1)c2ccccc2)c3C	ZINC000000068135	O=C(Nc1ccccc1)C(Sc2ccccc2)c3ccccc3
COc3cc(CNC[C@@H]2CCc1nc(N)nc(N)c1C2)cc(OC)c3OC	ZINC000005888740	C2Cc1ncncc1CC2CNCc3ccccc3
CC(=O)Nc2ccc(NC(=O)c1ccc(Cl)c(N(=O)=O)c1)cc2	ZINC000000060159	O=C(Nc1ccccc1)c2ccccc2
Cc3cccc(NC(=S)N(Cc1ccccc1)Cc2ccccn2)c3	ZINC000000270197	S=C(Nc1ccccc1)N(Cc2ccccc2)Cc3ccccn3
Cc2cccc(OCC(=O)Nc1ccc(CC#N)cc1)c2	ZINC000000037210	O=C(COc1ccccc1)Nc2ccccc2
COc3ccc(C(=O)N(CCCN1CCN(C)CC1)CCC(=O)N2CCNCC2)cc3	ZINC000035422000	O=C(CCN(CCCN1CCNCC1)C(=O)c2ccccc2)N3CCNCC3
Cc1ncsc1[C@H](O)c2ccco2	ZINC000000019387	C(c1ccco1)c2cncs2
COc3ccc(c1ncnn1c2ccc(Br)cc2F)cc3	ZINC000000182355	c3ccc(c1ncnn1c2ccccc2)cc3
CCOC(=O)CN4CCN([C@H]2[C@H](O)C1(CCNCC1)c3ccccc23)CC4	ZINC000019841662	C4CN(C2CC1(CCNCC1)c3ccccc23)CCN4
Cc1ncsc1[C@H](O)c2ccsc2	ZINC000000019389	C(c1ccsc1)c2cncs2
Brc3ccc(n2c(=O)c1cccc(N(=O)=O)c1c2=O)nc3	ZINC000000194926	O=c2n(c1ccccn1)c(=O)c3ccccc23
C[N@@](CC2CCN(CCc1cccc(F)c1)CC2)Cc3nccn3C	ZINC000011819946	C2CN(CCc1ccccc1)CCC2CNCc3ncc[nH]3
Nc2ccn(CCN1[C@@H](CO)SCC1=O)c(=O)n2	ZINC000000022751	O=C1CSCN1CCn2cccnc2=O
Cc3ccc(NC(=O)[C@@H]1CC=CC[C@H]1C(=O)N2CCCCC2)cc3	ZINC000000054228	O=C(Nc1ccccc1)C2CC=CCC2C(=O)N3CCCCC3
CCOc2ccc(\C=N\c1ccc(Br)c(Cl)c1)cc2	ZINC000000066122	C(=Nc1ccccc1)c2ccccc2
CN(C)CCNC(=S)N3CCN(Cc1csc2ccccc12)CC3	ZINC000014160831	C3CN(Cc1csc2ccccc12)CCN3
Cc4cc(N3CCN(C(=O)CCc2cc1CNCCn1n2)CC3)nc(N)n4	ZINC000072436539	O=C(CCc2cc1CNCCn1n2)N4CCN(c3ccncn3)CC4
Clc1ccccc1CSCC(=O)Nc2ccccc2	ZINC000000036130	O=C(CSCc1ccccc1)Nc2ccccc2
C[C@@H](C[N+]1(C)CCOCC1)OC[C@@H]2CCC[N+]3(C)CCCC[C@H]23	ZINC000004029183	C3CCN2CCCC(COCCN1CCOCC1)C2C3
CN(C)CCNc2ccc(NCCN(C)C)c3c(=O)c1c(O)ccc(O)c1c(=O)c23	ZINC000005115297	O=c2c1ccccc1c(=O)c3ccccc23
CCc3ccc(c2csc(NC(=O)c1cccc(Cl)c1)n2)cc3	ZINC000000175427	O=C(Nc2nc(c1ccccc1)cs2)c3ccccc3
CCN(CC)CCNc2cc(C)nc3c(N1CCCCC1)cc(=O)c(=O)c23	ZINC000003000171	O=c3cc(N1CCCCC1)c2ncccc2c3=O
CN(C)C(=O)Cn2c(c1ccc(C)cc1)nc3ccc(Cl)nc23	ZINC000000011550	c3ccc(c2nc1cccnc1[nH]2)cc3
Oc1c(Cl)cc(Cl)cc1\C=N\c2cccc(C(F)(F)F)c2	ZINC000000058398	C(=Nc1ccccc1)c2ccccc2
NC(=O)CSc1nnnn1c2ccc(F)cc2F	ZINC000000034905	c2ccc(n1cnnn1)cc2
COC(=O)c1scc(C)c1NC(=O)c2ccc(C(F)(F)F)cc2	ZINC000000082655	O=C(Nc1ccsc1)c2ccccc2
ONC(=O)CCc2nc1ccccc1s2	ZINC000000026458	c2ccc1scnc1c2
COc3ccc(OC)c(Nc2nc(c1ccc(F)c(C)c1)cs2)c3	ZINC000000090746	N(c1ccccc1)c3nc(c2ccccc2)cs3
O=c4cc(c1ccccc1)c3ccc(OCc2ccccc2)cc3o4	ZINC000000045147	O=c4cc(c1ccccc1)c3ccc(OCc2ccccc2)cc3o4
Cc2c(NC(=O)Nc1[s+]nn(C)c1C)[s+]nn2C	ZINC000000501305	O=C(Nc1c[nH]n[s+]1)Nc2c[nH]n[s+]2
CCOc3ccc2cc(c1ccc(Br)cc1)c(=O)oc2c3	ZINC000000057978	O=c2oc1ccccc1cc2c3ccccc3
Cc2c(c1ccc(Br)cc1)c(=O)oc3cc(O)ccc23	ZINC000000057979	O=c2oc1ccccc1cc2c3ccccc3
COc2cc(C(=O)N[C@@H]1C[C@H](C)CC(C)(C)C1)cc(OC)c2OC	ZINC000000035987	O=C(NC1CCCCC1)c2ccccc2
CN(C)CCNC(=O)C[C@@H]1CCNC[C@@H]1Cc3cc(c2ccccc2)on3	ZINC000008623614	C3CNCC(Cc2cc(c1ccccc1)on2)C3
Cc3ccc(\C=N\N2CCN(c1ccccc1)CC2)s3	ZINC000000028635	C2CN(c1ccccc1)CCN2N=Cc3cccs3
O=c4c2nc1CCCn1c2c(=O)c5n3CCCc3nc45	ZINC000000008634	O=c4c2nc1CCCn1c2c(=O)c5n3CCCc3nc45
CCc2c(c1ccc(O)cc1)c4ccc3cccc2n34	ZINC000000008637	c4ccc(c1cc3cccc2ccc1n23)cc4
COc5ccc(c1coc4c1c(C)cc3oc(=O)c2CCCc2c34)cc5	ZINC000000095452	O=c5oc3ccc2c(c1ccccc1)coc2c3c4CCCc45
C[C@@H](CN(C)C)On2c(S[C@@H](C)CN(C)C)nc1ccccc1c2=O	ZINC000002409303	O=c1[nH]cnc2ccccc12
C3CN(CCN2CCN(c1ncccn1)CC2)CCN3	ZINC000037632009	C3CN(CCN2CCN(c1ncccn1)CC2)CCN3
COc3ccc(NC(=O)C(=C/c2ccc1OCOc1c2)/C#N)cc3	ZINC000000048011	O=C(Nc1ccccc1)C=Cc3ccc2OCOc2c3
Clc2c(C(=O)Nc1ccccc1)sc3ccccc23	ZINC000000037693	O=C(Nc1ccccc1)c3cc2ccccc2s3
O=C(Nc1ncccn1)c2ccccc2C(=O)Nc3ncccn3	ZINC000000036984	O=C(Nc1ncccn1)c2ccccc2C(=O)Nc3ncccn3
CSc2ccc(OCc1ncc(N(=O)=O)n1C)cc2	ZINC000000001448	C(Oc1ccccc1)c2ncc[nH]2
CC1(C)NC(=N)NC(=N)N1c3cccc(CSc2ccccc2)c3	ZINC000001587054	N=C3NCN(c2cccc(CSc1ccccc1)c2)C(=N)N3
C4COc3cc(/N=C/c2ccc(OCc1ccccc1)cc2)ccc3O4	ZINC000000062195	C4COc3cc(N=Cc2ccc(OCc1ccccc1)cc2)ccc3O4
CCN2CCC(NC(=O)C[N@@](C)CCOc1ccc(Cl)cc1)CC2	ZINC000008532480	O=C(CNCCOc1ccccc1)NC2CCNCC2
O[C@@H]2CCC[N@@](Cc1ccc(F)cc1)C[C@H]2NC(=O)c4ccc(OCCN3CCCC3)cc4	ZINC000012480568	O=C(NC2CCCCN(Cc1ccccc1)C2)c4ccc(OCCN3CCCC3)cc4
Clc3ccc(c2csc(N=NCc1ccco1)n2)cc3Cl	ZINC000000045498	C(N=Nc2nc(c1ccccc1)cs2)c3ccco3
O=N(=O)c3ccc(\C=N\c2sc1CCCCc1c2C#N)o3	ZINC000000037102	C3CCc2sc(N=Cc1ccco1)cc2C3
C[N@]2CC1(CCNCC1)C[C@@H]2C(=O)NCc4nc(Cc3cccs3)no4	ZINC000072430976	O=C(NCc2nc(Cc1cccs1)no2)C4CC3(CCNCC3)CN4
O[C@@H](COc1ccccc1CN3CCN(c2ncccn2)CC3)CN4CCCCC4	ZINC000012575299	C4CCN(CCCOc1ccccc1CN3CCN(c2ncccn2)CC3)CC4
COc2cc(C(=O)Nc1ccc(N(C)C)cc1)cc(OC)c2OC	ZINC000000000484	O=C(Nc1ccccc1)c2ccccc2
CC[C@@H](C)C(=O)Nc1cccc(Br)c1	ZINC000000030673	c1ccccc1
CC(=O)c2c(C)nc1ccc(Br)cc1c2c3ccccc3	ZINC000000044182	c3ccc(c1ccnc2ccccc12)cc3
Cc1ccccc1C(=O)N4CCN(c3nc2ccccc2s3)CC4	ZINC000000052879	O=C(N3CCN(c2nc1ccccc1s2)CC3)c4ccccc4
CC(=O)Nc1ccccc1C(=O)OCC(=O)c2ccc(N(=O)=O)cc2	ZINC000000062314	O=C(COC(=O)c1ccccc1)c2ccccc2
CC(C)(CO)NC(=O)[C@@H]2C[C@@H]1CCCC[C@@H]1C[N@]2C[C@@H](O)[C@@H](N)CSc3ccccc3	ZINC000022048461	C(CCN2CCC1CCCCC1C2)CSc3ccccc3
Brc2ccc(NC(=S)NCCC1=CCCCC1)nc2	ZINC000000008582	S=C(NCCC1=CCCCC1)Nc2ccccn2
COCCn1cnnc1CCNC(=O)[C@@H]3CC2(CCNCC2)C[N@]3C	ZINC000072447816	O=C(NCCc1nnc[nH]1)C3CC2(CCNCC2)CN3
CNC(=O)c3cccc(NC(=O)Cc2ccc1ccccc1c2)c3	ZINC000000007471	O=C(Cc2ccc1ccccc1c2)Nc3ccccc3
Nc1nnnn1/N=C/c2c(O)ccc3ccccc23	ZINC000000028010	C(=Nn1cnnn1)c2cccc3ccccc23
NCc4cn(C3CCN(CCn1c(=O)oc2ccccc12)CC3)nn4	ZINC000023231695	O=c2oc1ccccc1n2CCN4CCC(n3ccnn3)CC4
COc2ccc(Nc1ncc[nH]1)c(C)c2	ZINC000000020287	N(c1ccccc1)c2ncc[nH]2
Cc2c(C#N)c1ccccc1n2CC(=O)NCc4ccc3OCOc3c4	ZINC000000029033	O=C(Cn1ccc2ccccc12)NCc4ccc3OCOc3c4
Cc2c(C#N)c1ccccc1n2CC(=O)NCc3ccco3	ZINC000000029031	O=C(Cn1ccc2ccccc12)NCc3ccco3
Clc3cc(Cl)c2oc(=O)c(C(=O)Oc1ccccc1)cc2c3	ZINC000000058730	O=C(Oc1ccccc1)c3cc2ccccc2oc3=O
Clc2ccc(NC(=O)c1cc[nH]n1)cc2	ZINC000000028525	O=C(Nc1ccccc1)c2cc[nH]n2
CN(C)[C@@H]4CCN(C(=O)[C@H]3CNC[C@@H](COc2ccc1CCCc1c2)C3)C4	ZINC000014732231	O=C(C3CNCC(COc2ccc1CCCc1c2)C3)N4CCCC4
Cc3c(NC(=O)c1ccn[nH]1)c(=O)n(c2ccccc2)n3C	ZINC000000028522	O=C(Nc2c[nH]n(c1ccccc1)c2=O)c3ccn[nH]3
COc1ccccc1NC(=O)c2cc[nH]n2	ZINC000000028521	O=C(Nc1ccccc1)c2cc[nH]n2
Cc3nnc(CCNCc1ccccc1OC[C@@H](O)CN2CCCCC2)[nH]3	ZINC000014972193	C3CCN(CCCOc1ccccc1CNCCc2nnc[nH]2)CC3
COC(=O)c1ccccc1NC(=O)c2c(Cl)cccc2Cl	ZINC000000030120	O=C(Nc1ccccc1)c2ccccc2
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](O)[C@@H](N)CCCCN	ZINC000013451231	c2ccc1[nH]ccc1c2
Brc2ccc(CC(=O)NC[C@@H]1CCCO1)cc2	ZINC000000030456	O=C(Cc1ccccc1)NCC2CCCO2
CCCN(Cc1ccc(OC)c(OC)c1)[C@@H]2C[C@H](C)[N@@](C)C[C@@H]2C	ZINC000004763934	C2CC(NCc1ccccc1)CCN2
O=c2[nH]c3ccc(CNS(=O)(=O)c1ccccc1)c4cccc2c34	ZINC000000072098	O=c2[nH]c3ccc(CNS(=O)(=O)c1ccccc1)c4cccc2c34
CCOC(=O)[C@@H](C)Oc3ccc2c(oc(=O)c1ccccc12)c3C	ZINC000000046573	O=c2oc1ccccc1c3ccccc23
CCOC(=O)c1sc(N)c(C#N)c1C	ZINC000000075910	c1ccsc1
CC(=O)N(CC[C@@H](c1ccc(C)cc1)c2ccco2)Cc3ccccc3	ZINC000000209111	C(CC(c1ccccc1)c2ccco2)NCc3ccccc3
O=C2N=C(NC1CC1)O[C@H]2c3ccccc3	ZINC000000000190	O=C2N=C(NC1CC1)OC2c3ccccc3
Clc4ccc(NC(=O)C2c1ccccc1Oc3ccccc23)nc4	ZINC000000030292	O=C(Nc1ccccn1)C3c2ccccc2Oc4ccccc34
Nc2nc(c1ccncc1)cc(=O)[nH]2	ZINC000000025651	O=c2cc(c1ccncc1)nc[nH]2
CCC(CC)n1ccc3c1ccc2nc(N)nc(N)c23	ZINC000000015885	c3ncc2c(ccc1[nH]ccc12)n3
O=C(Nc2ccc(C1=NCCN1)cc2)c5cc4ccc(C3=NCCN3)cc4[nH]5	ZINC000006535484	O=C(Nc2ccc(C1=NCCN1)cc2)c5cc4ccc(C3=NCCN3)cc4[nH]5
Nc2c1ccccc1nc3c(C(=O)NCCNCCO)cccc23	ZINC000006117626	c3ccc2nc1ccccc1cc2c3
CC(C)(C)NC(=O)c2ccc(COc1ccc(Cl)cc1Cl)o2	ZINC000000115358	C(Oc1ccccc1)c2ccco2
Cn1ccnc1S(=O)(=O)C(=C/c3ccc2OCOc2c3)/C#N	ZINC000000096358	O=S(=O)(C=Cc2ccc1OCOc1c2)c3ncc[nH]3
C[C@]2(CCCOc1ccc(N)cc1)NC(=N)NC(=N)N2c3ccccc3	ZINC000001703067	N=C3NC(CCCOc1ccccc1)N(c2ccccc2)C(=N)N3
Brc3cncc(C(=O)Nc2ccc1OCOc1c2)c3	ZINC000000037927	O=C(Nc2ccc1OCOc1c2)c3cccnc3
Cc2ccc(OC(=O)c1ccccc1N(=O)=O)cn2	ZINC000000043537	O=C(Oc1cccnc1)c2ccccc2
Brc2ccc(NC(=O)c1ccccc1N(=O)=O)nc2	ZINC000000043536	O=C(Nc1ccccn1)c2ccccc2
CN2[C@@H](CCC(=O)Nc1ccccc1)CNC(=O)[C@@H]3[C@H]2CCN3Cc4ncc[nH]4	ZINC000096536597	O=C(CCC3CNC(=O)C1C(CCN1Cc2ncc[nH]2)N3)Nc4ccccc4
CCN(CC)CCn2c(CCN1CCOCC1)nc3ccccc23	ZINC000002016511	C3CN(CCc2nc1ccccc1[nH]2)CCO3
Clc3ccc2sc(SCC(=O)NC[C@@H]1CCCO1)nc2c3	ZINC000000034353	O=C(CSc2nc1ccccc1s2)NCC3CCCO3
CC(=O)Nc3ccc(Nc2nc(c1cccnc1)cs2)cc3	ZINC000000088652	N(c1ccccc1)c3nc(c2cccnc2)cs3
Cc4ccc(c3noc(COc2ccc1OCOc1c2)n3)cc4	ZINC000000034118	C4Oc3ccc(OCc2nc(c1ccccc1)no2)cc3O4
CCn2c(=C\C=C1C(=O)OC(C)(C)OC1=O)/sc3ccccc23	ZINC000000028044	O=C1OCOC(=O)C1=CC=c3[nH]c2ccccc2s3
CCN(C(=O)COc1ccccc1)c2ccccc2	ZINC000000030929	O=C(COc1ccccc1)Nc2ccccc2
CCCN3CCC(N2CCC(O)(c1ccc(Br)cc1)CC2)CC3	ZINC000000757905	C3CC(N2CCC(c1ccccc1)CC2)CCN3
Cc2cc(S(=O)(=O)N1CCOCC1)c(C)cc2Br	ZINC000000036221	O=S(=O)(N1CCOCC1)c2ccccc2
Fc2ccc(NC(=S)Nc1ccc(F)c(Cl)c1)cc2	ZINC000000040862	S=C(Nc1ccccc1)Nc2ccccc2
COC(=O)C1=C(C)NC(=O)N[C@@H]1c2ccccc2SC(F)F	ZINC000000003681	O=C2NC=CC(c1ccccc1)N2
COc2ccc(CNC(=O)c1ccc(C)c(C)c1)cc2	ZINC000000029936	O=C(NCc1ccccc1)c2ccccc2
Cc2c(/N=C/c1cc(Br)ccc1O)cccc2N(=O)=O	ZINC000000045819	C(=Nc1ccccc1)c2ccccc2
COc2cc(OC)cc(C(=O)Nc1ccc(F)c(F)c1)c2	ZINC000000029933	O=C(Nc1ccccc1)c2ccccc2
CCN2CCC(NC[C@@H](O)COCc1ccc(Cl)cc1)CC2	ZINC000003354072	C(CNC1CCNCC1)COCc2ccccc2
O=C(Cc1ccccc1)N2CSC[C@@H]2C(=O)N3CCCC3	ZINC000000025344	O=C(Cc1ccccc1)N2CSCC2C(=O)N3CCCC3
CNc1nccn2c(Br)cnc12	ZINC000000003750	c2cn1ccnc1cn2
Brc1cscc1Cc2c[nH]cn2	ZINC000000008936	C(c1ccsc1)c2c[nH]cn2
S=C(NCc1ccco1)Nc2nccs2	ZINC000000008935	S=C(NCc1ccco1)Nc2nccs2
CC[C@@H](C(=O)Nc1nnc(C)s1)c2ccccc2	ZINC000000031723	O=C(Cc1ccccc1)Nc2nncs2
c1ccc3c(c1)ncc2ncnnc23	ZINC000000002080	c1ccc3c(c1)ncc2ncnnc23
COc2ccc([C@@H](CN(=O)=O)n1nc(C)cc1C)c(OC)c2	ZINC000000075175	C(c1ccccc1)n2cccn2
NC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000000002088	c1ccccc1
CN2C(=O)[C@@](O)(CC(=O)c1cccnc1)c3ccccc23	ZINC000000033543	O=C(CC1C(=O)Nc2ccccc12)c3cccnc3
NCC(=O)N[C@H](CCCNC(N)=N)C(=O)Nc1ccc(N(=O)=O)cc1	ZINC000004545953	c1ccccc1
CCSc3nnc2c(O[C@@H](C)Nc1ccccc12)n3	ZINC000000086167	C3Nc1ccccc1c2nncnc2O3
COCc3cc(C)c(C#N)c(SCc2nc1ccccc1[nH]2)n3	ZINC000000050012	C(Sc1ccccn1)c3nc2ccccc2[nH]3
COc3ccc(OC)c(N2C(=O)C[C@H](Cc1ccc(C)cc1)C2=O)c3	ZINC000000032299	O=C2CC(Cc1ccccc1)C(=O)N2c3ccccc3
O=C(NCCC(c1ccccc1)c2ccccc2)c3cccs3	ZINC000000035407	O=C(NCCC(c1ccccc1)c2ccccc2)c3cccs3
CCOc1ccccc1N(CC(=O)Nc2cccnc2)S(C)(=O)=O	ZINC000000329026	O=C(CNc1ccccc1)Nc2cccnc2
O=C(CC[n+]1ccccc1)OCCOC(=O)CC[n+]2ccccc2	ZINC000004774981	O=C(CC[n+]1ccccc1)OCCOC(=O)CC[n+]2ccccc2
CCOc3ccc(\C=c2\c(c1ccc(N(=O)=O)cc1)noc2=O)cc3	ZINC000000032184	O=c2onc(c1ccccc1)c2=Cc3ccccc3
Cc1ncc(N(=O)=O)n1CCOC(=O)c2cccs2	ZINC000000033900	O=C(OCCn1ccnc1)c2cccs2
Cc3ccc(NC(=O)CSc1nnc2n(N)cnn12)cc3	ZINC000000034902	O=C(CSc1nnc2[nH]cnn12)Nc3ccccc3
C[N@@](CCN1CCOCC1)Cc2ccccc2OC[C@@H](O)CN3CCSCC3	ZINC000020406386	C(COc1ccccc1CNCCN2CCOCC2)CN3CCSCC3
COc4ccc(NC(=O)C2C(c1ccccc1)=C2c3ccccc3)cc4	ZINC000000051289	O=C(Nc1ccccc1)C3C(c2ccccc2)=C3c4ccccc4
CN3CCN(C(=O)c2cn(CC[C@@H]1CCCCN1)nn2)CC34CCNCC4	ZINC000077288103	O=C(N2CCNC1(CCNCC1)C2)c4cn(CCC3CCCCN3)nn4
CC(=O)NN3[C@@H](c1ccccc1O)Nc2ccccc2C3=O	ZINC000000032163	O=C2NC(c1ccccc1)Nc3ccccc23
C[C@@H]3C(C)=NN(CCN1CCN(C)CC1)c4nc2n(C)c(=O)n(C)c(=O)c2n34	ZINC000020713657	O=c4[nH]c(=O)c3n2CC=NN(CCN1CCNCC1)c2nc3[nH]4
S=c2sc1ccccc1n2Cn3c(=S)sc4ccccc34	ZINC000000365108	S=c2sc1ccccc1n2Cn3c(=S)sc4ccccc34
Cc2nc(SCC(=O)OCc1ccccc1)c(C#N)c(C)c2C	ZINC000000050126	O=C(CSc1ccccn1)OCc2ccccc2
Cc3ccc(C(=O)c2oc1nc(C)ccc1c2NC(N)=O)c(C)n3	ZINC000000023188	O=C(c1cccnc1)c3cc2cccnc2o3
CCOc2ccc([C@@H](CC(=O)c1ccccc1)C(C#N)C#N)cc2OC	ZINC000000377304	O=C(CCc1ccccc1)c2ccccc2
COc2ccc(CN1CCC[C@@H](CN)C1)cc2OC	ZINC000011888407	C2CCN(Cc1ccccc1)CC2
COc4ccc(N3C(=O)C[C@H](NC2CCN(c1cc(C)nc(C)n1)CC2)C3=O)cc4	ZINC000004770827	O=C3CC(NC2CCN(c1ccncn1)CC2)C(=O)N3c4ccccc4
CSc3ccc(\C=c2/c(=O)nc1snc(SC)n1c2=N)cc3	ZINC000000214080	N=c2c(=Cc1ccccc1)c(=O)nc3sncn23
COc3ccc(CCNc1ncnc2sc(C)c(C)c12)cc3OC	ZINC000000087381	C(Cc1ccccc1)Nc2ncnc3sccc23
COc2ccc([C@H]1CCN(C(C)=O)C1)cc2OC3CCCC3	ZINC000000019959	C3CCC(Oc2cccc(C1CCNC1)c2)C3
COc4ccc(c3noc(CN2CCC(C(=O)NCCN1CCCC1)CC2)n3)cc4OC	ZINC000020940412	O=C(NCCN1CCCC1)C4CCN(Cc3nc(c2ccccc2)no3)CC4
C[N+]1=c2cc(N)c(=O)c3[nH]cc(CC1)c23	ZINC000000019950	O=c1ccc3=NCCc2c[nH]c1c23
CN(C)Cc3cc(C2CCN(C(=O)[C@@H]1CCCNC1)CC2)nn3C	ZINC000019710236	O=C(C1CCCNC1)N3CCC(c2cc[nH]n2)CC3
CC[C@H]3CN(C(=O)c2ccc(N(C)CCn1ccnc1C)nc2)CC[N@]3C(C)C	ZINC000012305667	O=C(N1CCNCC1)c3ccc(NCCn2ccnc2)nc3
COc2ccc(CN1CC[C@@H](NCCCN(C)C)[C@H](O)C1)cc2	ZINC000012146524	C2CCN(Cc1ccccc1)CC2
O=C1CCCc2c1cnn2Cc3ccccc3	ZINC000000018555	O=C1CCCc2c1cnn2Cc3ccccc3
CCc3nnc(SCC(=O)N1CCCc2ccccc12)n3N	ZINC000000111701	O=C(CSc1nnc[nH]1)N2CCCc3ccccc23
O=C(COC(=O)c1ccccc1C(=O)c2ccccc2)c3ccccc3	ZINC000000072816	O=C(COC(=O)c1ccccc1C(=O)c2ccccc2)c3ccccc3
NCc4cc(=O)[nH]c(c3cccc(C[N@]1CCC[C@@H]1Cn2ccnc2)c3)n4	ZINC000039489890	O=c4ccnc(c3cccc(CN1CCCC1Cn2ccnc2)c3)[nH]4
CN5CCC([N@@]1C[C@@H]4C[C@H](C1)c3ccc(NC(=O)NC2CCCCC2)c(=O)n3C4)CC5	ZINC000004260367	O=C(NC1CCCCC1)Nc5ccc4C3CC(CN(C2CCNCC2)C3)Cn4c5=O
CC[N@]3CCC[C@@H](CN2CCC(N1CCSCC1)CC2)C3	ZINC000019790121	C3CNCC(CN2CCC(N1CCSCC1)CC2)C3
CN3CCC([N@]2CCC[C@@H](C(=O)N(C)CCc1c(C)n[nH]c1C)C2)CC3	ZINC000012303444	O=C(NCCc1cn[nH]c1)C3CCCN(C2CCNCC2)C3
Cc1cccc(C)c1N(CC(=O)NC2CCCC2)S(C)(=O)=O	ZINC000000036538	O=C(CNc1ccccc1)NC2CCCC2
COC(=O)CCC(=O)Nc2sc1CCCCc1c2C(=O)OC	ZINC000000038900	C2CCc1sccc1C2
CC[N@@](CCn1cccn1)Cc3cccc(OC[C@@H](O)CN2CCC(O)CC2)c3	ZINC000011813800	C3CCN(CCCOc2cccc(CNCCn1cccn1)c2)CC3
CC(C)N3C(=O)[C@H]2Cc1nc[nH]c1CN2C3=O	ZINC000000009515	O=C3NC(=O)N2Cc1[nH]cnc1CC23
CN4CCC([N@]3CCC[C@@H](C(=O)NCc2cn1ccccc1n2)C3)CC4	ZINC000011819208	O=C(NCc2cn1ccccc1n2)C4CCCN(C3CCNCC3)C4
CC(N=Nc1ncc(C(C)=NNC(N)=N)c(C)n1)c2cnc(NN)nc2C	ZINC000016941948	C(N=Nc1ncccn1)c2cncnc2
CN2CCN(c1nccs1)CC2	ZINC000000022036	C2CN(c1nccs1)CCN2
Cc3ccc(C(=O)Nc2nc1ccccc1c(=O)n2C)cc3	ZINC000000015392	O=C(Nc2nc1ccccc1c(=O)[nH]2)c3ccccc3
CC(C)c2ccc(CNC(=O)c1ccccc1Cl)cc2	ZINC000000036064	O=C(NCc1ccccc1)c2ccccc2
C[C@H]3CN(C(C)(C)CNC(=O)c2nnn(C1CCNCC1)c2C)C[C@H](C)O3	ZINC000237596301	O=C(NCCN1CCOCC1)c3cn(C2CCNCC2)nn3
O[C@H]2c1ccccc1C[N+](=O)C23CCCCC3	ZINC000000021721	O=[N+]2Cc1ccccc1CC23CCCCC3
O=C(CN1CCCCC1)NCCNC(=O)CN2CCCCC2	ZINC000004197586	O=C(CN1CCCCC1)NCCNC(=O)CN2CCCCC2
Cn4nc(C(=O)NCCN1CCCCC1)c3C[C@H](NCc2ccco2)CCc34	ZINC000019143582	O=C(NCCN1CCCCC1)c4n[nH]c3CCC(NCc2ccco2)Cc34
Clc1ccc(Cl)c(S(=O)(=O)N(CC#N)CC#N)c1	ZINC000000029488	c1ccccc1
COc1ccccc1C(=O)Nc2nc(C)c(C(C)=O)s2	ZINC000000035639	O=C(Nc1nccs1)c2ccccc2
C[C@@H]2C[C@H](OC(=O)CN1CCCC1=O)CC(C)(C)C2	ZINC000000000636	O=C(CN1CCCC1=O)OC2CCCCC2
CCCCN4CCN(Cc3cc2CN(c1nccc(N)n1)CCn2n3)CC4	ZINC000072463173	C4CN(Cc3cc2CN(c1ncccn1)CCn2n3)CCN4
COC(=O)c1ccccc1O	ZINC000000000490	c1ccccc1
CC(C)N3CCC([N@]2CCC[C@@H](C(=O)NCCc1cccc(C)n1)C2)CC3	ZINC000011821990	O=C(NCCc1ccccn1)C3CCCN(C2CCNCC2)C3
OC(=O)CNCc1ccccc1O	ZINC000000019040	c1ccccc1
CN3CCN([C@H]2C[N@@](Cc1cc(C)c(OC(C)=O)c(C)c1)C[C@@H]2O)CC3	ZINC000055108993	C3CN(C2CCN(Cc1ccccc1)C2)CCN3
CSc3nc(N)n2nc(c1ccccc1)cc2n3	ZINC000000094994	c3ccc(c2cc1ncncn1n2)cc3
O=c4c2cnc1ccccc1c2c(=O)c5[nH]c3ccccc3c45	ZINC000000026338	O=c4c2cnc1ccccc1c2c(=O)c5[nH]c3ccccc3c45
CCN4CCN(Cc3nc(c2c(C)ncc1CNCCc12)no3)CC4	ZINC000019790118	C4CN(Cc3nc(c2cncc1CNCCc12)no3)CCN4
C[C@@]34CC[C@@H]1[C@H](CCc2cc(O)ccc12)[C@H]3C[C@@H](O)C4=O	ZINC000000001543	O=C4CCC3C2CCc1ccccc1C2CCC34
COc1ccc(O)c([C@H](N)C(O)=O)c1	ZINC000000021859	c1ccccc1
CN2C(=O)N[C@H](c1ccccc1)C4=C2CN(c3ccc(C)c(C)c3)C4=O	ZINC000000082971	O=C4NC(c1ccccc1)C3=C(CN(c2ccccc2)C3=O)N4
CN4CCN(C[C@@H]3C[N@@](Cc2ccc1nsnc1c2)C[C@@H]3CO)CC4	ZINC000095371261	C4CN(CC3CCN(Cc2ccc1nsnc1c2)C3)CCN4
Cn1ccnc1SCC(=O)Nc2ccccn2	ZINC000000051744	O=C(CSc1ncc[nH]1)Nc2ccccn2
C/C=C(\C)C[N@@]3CCc2nnc([C@@H](C)NC(=O)C1CCN(C)CC1)n2CC3	ZINC000011971482	O=C(NCc2nnc1CCNCCn12)C3CCNCC3
CCN(C(=O)c1cc(Cl)ccc1OC)c2ccccc2	ZINC000000030822	O=C(Nc1ccccc1)c2ccccc2
Cc1ccc(Cl)cc1NC(=O)[C@H]3CN(C2CCCCC2)C(=O)C3	ZINC000000048204	O=C2CC(C(=O)Nc1ccccc1)CN2C3CCCCC3
CCCNCc1cccn1c3nnc(N2CCN(C)CC2)s3	ZINC000021531670	C3CN(c2nnc(n1cccc1)s2)CCN3
NS(=O)(=O)c2ccc1c(C=CS1(=O)=O)c2	ZINC000000026296	O=S2(=O)C=Cc1ccccc12
CN(C)CCN4C(=O)C[C@@](CC(=O)N2CCN(C1CCCC1)CC2)(c3ccccc3F)C4=O	ZINC000015006276	O=C4CC(CC(=O)N2CCN(C1CCCC1)CC2)(c3ccccc3)C(=O)N4
CC(=O)c2nnn(c1ccccc1)c2Nc3ccccc3	ZINC000000027889	N(c1ccccc1)c2cnnn2c3ccccc3
CC(C)(O)C[C@](C)(O)c1ccc(Cl)cc1	ZINC000000000303	c1ccccc1
CCCc2cc(=O)oc3cc(OC(=O)c1ccc(Cl)cc1)ccc23	ZINC000000090172	O=C(Oc2ccc1ccc(=O)oc1c2)c3ccccc3
CN[C@H]1Cc2cccc3[nH]c(=O)n(C1)c23	ZINC000000007049	O=c1[nH]c3cccc2CCCn1c23
O=C(Nc2sc1CCCc1c2C#N)\C=C\c3cccc(N(=O)=O)c3	ZINC000000038722	O=C(Nc2cc1CCCc1s2)C=Cc3ccccc3
CCN2[C@@H](SCC(=O)Nc1ccc(Cl)cc1)Nc3ccccc23	ZINC000000029021	O=C(CSC2Nc1ccccc1N2)Nc3ccccc3
NCCNc2ccc(NCCN)c3c(=O)c1ccccc1c(=O)c23	ZINC000005117467	O=c2c1ccccc1c(=O)c3ccccc23
COC(=O)CCc2[nH]c1c(C)cccc1c2Sc3ccc(C)cc3	ZINC000000036653	S(c1ccccc1)c2c[nH]c3ccccc23
O=C(Cn1cc(C#N)c2ccccc12)NCc3ccccc3	ZINC000000029024	O=C(Cn1ccc2ccccc12)NCc3ccccc3
Cn3c1C(=N\O)\CCCc1c4cc(C2CCCCC2)ccc34	ZINC000000028945	N=C1CCCc3c1[nH]c4ccc(C2CCCCC2)cc34
CCOC(=O)N2CCN(Cc1oc(CO)cc(=O)c1O)CC2	ZINC000000038268	O=c2ccoc(CN1CCNCC1)c2
FC(F)(F)Oc2ccc(NC(=O)CSC1=NCCS1)cc2	ZINC000000034293	O=C(CSC1=NCCS1)Nc2ccccc2
O=C(Cn1cc(N(=O)=O)cn1)Nc3ccn(Cc2ccccc2)n3	ZINC000000374926	O=C(Cn1cccn1)Nc3ccn(Cc2ccccc2)n3
CN(C)CCNC(=O)C2CCN(CCn1cc(N(=O)=O)ccc1=O)CC2	ZINC000090553841	O=c1ccccn1CCN2CCCCC2
CCc3cccc(NC(=S)Nc1ccc(C)c(C)c1n2cccc2)c3	ZINC000000264014	S=C(Nc1ccccc1)Nc2ccccc2n3cccc3
CC(C)CN1CCO[C@@H](CNC(=O)CN(CC(N)=O)C(C)C)C1	ZINC000016419763	C1COCCN1
O=c2[nH]c(c1ccccc1)cn3ccnc23	ZINC000000006400	O=c2[nH]c(c1ccccc1)cn3ccnc23
Clc3ccc(Cl)c4[C@H]1C=CC[C@H]1[C@@H](c2cccnc2)Nc34	ZINC000000037715	C1C=CC3C1C(c2cccnc2)Nc4ccccc34
CC[N@]1CCC[C@@H]1CN(CC(=O)N2CCNCC2)S(=O)(=O)c3ccc(OC)cc3	ZINC000045974493	O=C(CN(CC1CCCN1)S(=O)(=O)c2ccccc2)N3CCNCC3
N[C@H](C(O)=O)c1ccccc1O	ZINC000000006795	c1ccccc1
CC(=O)Nc2ccc(S(=O)(=O)Nc1ccc(Cl)cn1)cc2	ZINC000000030289	O=S(=O)(Nc1ccccn1)c2ccccc2
C[N+](C)(C)CCOC(=O)[C@@H]2CCC[N+](C)(Cc1ccccc1Cl)C2	ZINC000004692651	C2CCN(Cc1ccccc1)CC2
NS(=O)(=O)c3ccc(c2ccc(\C=N\n1cnnc1)o2)cc3	ZINC000000034100	C(=Nn1cnnc1)c3ccc(c2ccccc2)o3
NCc4ccc(c2nc1ccccc1n2OC[C@@H]3C[C@@H](O)CN3)cc4	ZINC000039291730	C4CNC(COn2c(c1ccccc1)nc3ccccc23)C4
COc3cc2ncnc(Nc1ccc(O)cc1)c2cc3OC	ZINC000000009851	N(c1ccccc1)c2ncnc3ccccc23
Clc1ccccc1C(=O)O/N=C/c3ccc2OCOc2c3	ZINC000000041651	O=C(ON=Cc2ccc1OCOc1c2)c3ccccc3
COc3cc(\C=N\n2cnc1n(C)c(=S)sc1c2=O)ccc3O	ZINC000000156816	O=c2n(N=Cc1ccccc1)cnc3[nH]c(=S)sc23
CCCN2CCC([N@@](C)CCc1ccc(OC)c(OC)c1)CC2	ZINC000004989517	C2CC(NCCc1ccccc1)CCN2
CCOC(=O)CNc2nc(C#N)nc(N1CCOCC1)n2	ZINC000000105012	C2CN(c1ncncn1)CCO2
COc2cc(=O)n(C)c3c(OC[C@@H]1OC(C)(C)OC1(C)C)cccc23	ZINC000000199411	O=c3ccc2cccc(OCC1COCO1)c2[nH]3
COCCNC(=O)[C@H]1C[N@]2CC[C@@H]1C[C@@H]2Cn4cc(CN(C)Cc3ccccc3)nn4	ZINC000008297667	C1CN2CCC1CC2Cn4cc(CNCc3ccccc3)nn4
O=C(NCCc1ccccc1)c3cc2CCCCc2[nH]c3=O	ZINC000000034618	O=C(NCCc1ccccc1)c3cc2CCCCc2[nH]c3=O
COc3cc([C@@H]2CC(=O)Nc1ccccc1S2)cc(OC)c3OC	ZINC000000098904	O=C3CC(c1ccccc1)Sc2ccccc2N3
Cc4cc(=O)n3[C@@H](c1ccccc1)NC(=NCCN2CCCCC2)Nc3n4	ZINC000009289396	O=c4ccnc3NC(=NCCN1CCCCC1)NC(c2ccccc2)n34
Fc2ccc(NC(=S)NC[C@@H]1CCCO1)cc2Cl	ZINC000000034616	S=C(NCC1CCCO1)Nc2ccccc2
CCN(CC)CCN(C)C(=O)C[C@@]2(c1cccc(F)c1)CC(=O)N(CCN(C)C)C2=O	ZINC000012034867	O=C2CC(c1ccccc1)C(=O)N2
Clc3ccc(\C=N\c1ccccc1C(=O)Nc2ccccc2)cc3	ZINC000000065649	O=C(Nc1ccccc1)c2ccccc2N=Cc3ccccc3
COC(=O)c2ccc(CN(C)c1cc(OC)c(OC)c(OC)c1)cc2	ZINC000000015709	C(Nc1ccccc1)c2ccccc2
C1CCc4c(C1)sc5ncnc(n2nnc3ccccc23)c45	ZINC000000042325	C1CCc4c(C1)sc5ncnc(n2nnc3ccccc23)c45
CCc3ccc(N2[C@@H](c1ccc(Cl)cc1)S(=O)(=O)CC2=O)cc3	ZINC000000031854	O=C2CS(=O)(=O)C(c1ccccc1)N2c3ccccc3
CN(C)C(=O)CSc2nnc(c1cccnc1)n2c3ccccc3	ZINC000000056377	c3ccc(n1cnnc1c2cccnc2)cc3
CN4CCC([N@]3CCC[C@@H](NC(=O)c2cnn(c1ccccc1)c2)C3)CC4	ZINC000020454855	O=C(NC2CCCN(C1CCNCC1)C2)c4cnn(c3ccccc3)c4
CN5CCN(C(=O)[C@H]2C[N@@](Cc1ccccc1)C[C@@H]2c4ccnc(N3CCCC3)n4)CC5	ZINC000019589771	O=C(C2CN(Cc1ccccc1)CC2c4ccnc(N3CCCC3)n4)N5CCNCC5
CCOC(=O)[C@@H]2CCCN(C(=O)c1ccccc1)C2	ZINC000000030938	O=C(N1CCCCC1)c2ccccc2
CN3CCC(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N2CCCC2)CC3	ZINC000020465045	C3CCN(C1CCOC1CNC2CCNCC2)C3
NCc4cn(C3CCN(Cc2ccc1nonc1c2)CC3)nn4	ZINC000023399391	C3CN(Cc2ccc1nonc1c2)CCC3n4ccnn4
CC(C=NNC1=NCCCN1)=NN=C2NCCCN2	ZINC000008665445	C2CNC(=NN=CC=NNC1=NCCCN1)NC2
CN(\N=C/C=N\N(C)C1=NCCCN1)C2=NCCCN2	ZINC000008665447	C2CNC(NN=CC=NNC1=NCCCN1)=NC2
CC[C@@]1(O)C(=O)OCc5c1cc4c3nc2ccccc2cc3Cn4c5=O	ZINC000000105309	O=C5Cc4cc3c2nc1ccccc1cc2Cn3c(=O)c4CO5
NC(=N)NC(=N)N(Cc1ccccc1)Cc2ccccc2	ZINC000005052840	C(NCc1ccccc1)c2ccccc2
C[C@@H](CNC(=O)N2CCC[N@@](Cc1cnn(C)c1)CC2)N3CCOCC3	ZINC000115796653	O=C(NCCN1CCOCC1)N3CCCN(Cc2cn[nH]c2)CC3
C[C@@H](N(O)C(N)=O)c1ccc(Cl)cc1	ZINC000000013399	c1ccccc1
CN4CCN(c2c1CCCCc1nc3ccccc23)CC4	ZINC000001699154	C1CCc3c(C1)nc2ccccc2c3N4CCNCC4
C[N+]2(CCCCC[N+]1(C)CCCCC1)CCCCC2	ZINC000006068242	C2CCN(CCCCCN1CCCCC1)CC2
Cn2ncc3c(NNS(=O)(=O)c1ccccc1)ncnc23	ZINC000000116949	O=S(=O)(NNc1ncnc2[nH]ncc12)c3ccccc3
O=S(=O)(Cc1ccccc1)N3CCc2ccccc2C3	ZINC000000029835	O=S(=O)(Cc1ccccc1)N3CCc2ccccc2C3
O=S(=O)(Cc1ccccc1)NC2CCCCCC2	ZINC000000029833	O=S(=O)(Cc1ccccc1)NC2CCCCCC2
COc3ccc2c(OC)c1ccoc1nc2c3OC	ZINC000000035525	c3ccc2nc1occc1cc2c3
Cc3c(C(=O)Nc2nnc(CC1CCCC1)s2)cccc3N(=O)=O	ZINC000000372856	O=C(Nc2nnc(CC1CCCC1)s2)c3ccccc3
Nc3nccc(c2ccc1OCCOc1c2)n3	ZINC000000079932	C3COc2cc(c1ccncn1)ccc2O3
Cc2cccc(NC(=O)CSc1ccccn1)c2C	ZINC000000031483	O=C(CSc1ccccn1)Nc2ccccc2
NC(=N)c3cccc(Oc2ccc(C(N)=O)c(Oc1cccc(C(N)=N)c1)n2)c3	ZINC000013797418	O(c1ccccc1)c3cccc(Oc2ccccc2)n3
COc2c1C[C@H]([C@@](C)(O)CO)Oc1nc3ccccc23	ZINC000000035529	C3Cc2cc1ccccc1nc2O3
Clc1ccccc1c3nnc(c2ccc(Br)cc2)o3	ZINC000000054851	c3ccc(c2nnc(c1ccccc1)o2)cc3
CN1CCc5c([C@H]1c2cccnc2)c4[C@@H](c3cccnc3)[N@@](C)CCc4n5C	ZINC000001305704	C5Cc3[nH]c2CCNC(c1cccnc1)c2c3C(c4cccnc4)N5
CCn2ccc(NS(=O)(=O)c1ccc(N)cc1)nc2=O	ZINC000000002092	O=c2nc(NS(=O)(=O)c1ccccc1)cc[nH]2
C[C@]23CCC[C@]1(CO1)[C@@H]2C[C@H]4[C@@H](C3)OC(=O)[C@@H]4CNCCCn5ccnc5	ZINC000003985049	O=C4OC3CC2CCCC1(CO1)C2CC3C4CNCCCn5ccnc5
CC(C)(CN1CCOCC1)C[N@]4CC[C@@H](N3CCN(CCc2ccccc2)CC3)[C@H](O)C4	ZINC000020774826	C(CN1CCOCC1)CN4CCC(N3CCN(CCc2ccccc2)CC3)CC4
C1Cc4c(C1)c(CN2CCOCC2)c3CCCc3c4CN5CCOCC5	ZINC000019802248	C1Cc4c(C1)c(CN2CCOCC2)c3CCCc3c4CN5CCOCC5
Cc3cccc(NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Oc2ccccc2)c3	ZINC000000062974	O=C(Nc1ccccc1)C2CCCN2C(=O)Oc3ccccc3
CN(C)CCCNc2nc(NCCCN(C)C)c1nc(C)c(C)nc1n2	ZINC000001646507	c2cnc1ncncc1n2
CC[N+](C)(CC)CCOc1n[n+](C)cc2ccccc12	ZINC000005469369	c2ccc1cnncc1c2
O=C(NCc1ccccn1)\C=C\C(=O)c2cccc(N(=O)=O)c2	ZINC000000035258	O=C(NCc1ccccn1)C=CC(=O)c2ccccc2
COc1ccccc1N4CCN([C@@H]3CCCN(C(=O)C2CCN(C)CC2)C3)CC4	ZINC000011668101	O=C(C1CCNCC1)N4CCCC(N3CCN(c2ccccc2)CC3)C4
COc2ccc(OC[C@@H](O)CN(C)C)c(CNCc1ccc(C)o1)c2	ZINC000012430082	C(NCc1ccco1)c2ccccc2
COC(=O)c2sc1cc(N(=O)=O)ccc1c2N	ZINC000000032573	c2ccc1sccc1c2
CCOC(=O)n2nc(N)c1CN(C(=O)OC(C)(C)C)Cc12	ZINC000000002966	C1NCc2[nH]ncc12
COc2ccc(C(=O)OCC(=O)c1ccccc1)cc2Br	ZINC000000302828	O=C(COC(=O)c1ccccc1)c2ccccc2
CCc1ccccc1NC(=O)c2ccc(OC)cc2OC	ZINC000000029903	O=C(Nc1ccccc1)c2ccccc2
Cc3sc2ncn(CC(=O)NC[C@@H]1CCCO1)c(=O)c2c3C	ZINC000000109561	O=C(Cn2cnc1sccc1c2=O)NCC3CCCO3
Cc2cc(C)[n+]1cc(Br)ccc1n2	ZINC000000035416	c2cc[n+]1cccnc1c2
Cc3c(F)c(Oc1cccc(C(N)=N)c1)nc(Oc2cccc(C(N)=N)c2)c3F	ZINC000000585999	O(c1ccccc1)c3cccc(Oc2ccccc2)n3
CCN(CC)c2ccc(NC(=S)Nc1ccc(OC)cc1)c(C)c2	ZINC000000117704	S=C(Nc1ccccc1)Nc2ccccc2
COC(=O)c2cccc(NC(=S)N[C@H](C)c1ccc(Cl)cc1)c2	ZINC000000134468	S=C(NCc1ccccc1)Nc2ccccc2
Clc1ccccc1c3nc(c2ccncc2)no3	ZINC000000001947	c3ccc(c2nc(c1ccncc1)no2)cc3
C4CO[C@H](CNc2nc1ccccc1n3cncc23)C4	ZINC000000026938	C4COC(CNc2nc1ccccc1n3cncc23)C4
CCOC(=O)c3cn([C@H]1CC(O)(O)[C@@H]2OC[C@H]1O2)nc3N	ZINC000000093236	C2CC(n1cccn1)C3COC2O3
NCCn5cc(C(=O)N2C[C@@H](c1cccc(O)c1)[C@@H]3[C@H]2C4CCN3CC4)nn5	ZINC000072167584	O=C(N2CC(c1ccccc1)C3C2C4CCN3CC4)c5c[nH]nn5
CC(C)OC(=O)Cn3c(C)nc2n(c1ccccc1)ncc2c3=O	ZINC000000113753	O=c2[nH]cnc3n(c1ccccc1)ncc23
CCOc2cc(\C=c1\sc(NC(C)=O)nc1=O)cc(CC=C)c2O	ZINC000000202814	O=c1ncsc1=Cc2ccccc2
CCOC(=O)\C=C2/NC(C)(C)Cc3cc1OCCOc1cc23	ZINC000000033809	C=C2NCCc3cc1OCCOc1cc23
O=c2onc(c1ccco1)/c2=C/c3ccco3	ZINC000000032283	O=c2onc(c1ccco1)c2=Cc3ccco3
O=c3[nH]nc2CSc1ccccc1n23	ZINC000000003946	O=c3[nH]nc2CSc1ccccc1n23
CN(C)CCC(=O)C(=Cc1ccc(O)cc1)C(=O)CCN(C)C	ZINC000001579204	c1ccccc1
CC(C)c2nnc(NC(=O)CSc1nncn1C)s2	ZINC000000052697	O=C(CSc1nnc[nH]1)Nc2nncs2
COC(=O)[C@@H](C)c2ccc(c1ccsc1)cc2	ZINC000000003771	c2ccc(c1ccsc1)cc2
CCn3c(SCc1ccccn1)nc2ccccc2c3=O	ZINC000000003949	O=c2[nH]c(SCc1ccccn1)nc3ccccc23
O=C(c2cc1ccccc1oc2=O)n3cc(N(=O)=O)cn3	ZINC000000033376	O=C(c2cc1ccccc1oc2=O)n3cccn3
COc1ccc(CNCCNC(C)=O)cc1OC[C@@H](O)CN2CCCCC2	ZINC000011839804	C2CCN(CCCOc1ccccc1)CC2
OC[C@@H](O)[C@H](O)[C@@H](O)c2cnn(c1ccccc1)n2	ZINC000000046935	c2ccc(n1nccn1)cc2
CC(=O)c2c(C)nc(N1CCOCC1)nc2N3CCOCC3	ZINC000000046936	C3CN(c2ccnc(N1CCOCC1)n2)CCO3
CN(C)C3(CNC(=O)c2cn(CC[C@@H]1CCCCN1)nn2)CCOCC3	ZINC000077354865	O=C(NCC1CCOCC1)c3cn(CCC2CCCCN2)nn3
CC(C)OC[C@H](O)CN2CCN(CC(=O)N1CCN(C)CC1)CC2	ZINC000071279683	O=C(CN1CCNCC1)N2CCNCC2
O=C(c1ccccc1)c3ccc(N2CCCCC2)cc3	ZINC000000028986	O=C(c1ccccc1)c3ccc(N2CCCCC2)cc3
Cc4c(C#N)c3nc1CCCc1c(c2ccccc2)c3n4c5ccccc5	ZINC000000227050	C5Cc4nc2ccn(c1ccccc1)c2c(c3ccccc3)c4C5
COc3cccc(\C=c2/sc(N1CCC[C@H](C)C1)nc2=O)c3OC	ZINC000000082709	O=c2nc(N1CCCCC1)sc2=Cc3ccccc3
CCOc3cc(C=C2C(=O)OC1(CCCCC1)OC2=O)ccc3OC	ZINC000000103935	O=C2OC1(CCCCC1)OC(=O)C2=Cc3ccccc3
CN3CCN(C(=O)CC[C@@H]2CCC[N@@](Cc1cccc(O)c1)C2)CC3	ZINC000012208964	O=C(CCC2CCCN(Cc1ccccc1)C2)N3CCNCC3
Cc1nonc1NC(=O)Cn3c(=O)c2ccccc2c3=O	ZINC000000051356	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3cnon3
Fc1cccc(F)c1CSc3nc2ccccc2s3	ZINC000000036295	C(Sc2nc1ccccc1s2)c3ccccc3
COc2ccc(CC(=O)Nc1cc(N(=O)=O)ccc1F)cc2	ZINC000000038865	O=C(Cc1ccccc1)Nc2ccccc2
COC(=O)CCC(=O)Nc2nc(c1ccccc1)cs2	ZINC000000038860	c2ccc(c1cscn1)cc2
COC(=O)c1ccc(NS(C)(=O)=O)cc1	ZINC000000029687	c1ccccc1
O=C2C[C@@H](Nc1c[nH]c(=O)[nH]c1=O)C(=O)N2c3ccccc3	ZINC000000046597	O=C2CC(Nc1c[nH]c(=O)[nH]c1=O)C(=O)N2c3ccccc3
COc1ccccc1Nc3nc(c2ccccc2F)nc4ccccc34	ZINC000000215368	N(c1ccccc1)c3nc(c2ccccc2)nc4ccccc34
O=C(Nc1ccncc1)[C@@H](C#N)C(=O)C2CC2	ZINC000000018830	O=C(CC(=O)C1CC1)Nc2ccncc2
O=c3n(CCOc1ccccc1)cnc4sc(c2ccccc2)cc34	ZINC000000150930	O=c3n(CCOc1ccccc1)cnc4sc(c2ccccc2)cc34
NC(=O)c3c(NC(=O)CCc1ccccc1)sc2CCCCc23	ZINC000000046844	O=C(CCc1ccccc1)Nc3cc2CCCCc2s3
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)COc3ccc(C)nc3CC	ZINC000011874714	O=C(COc1cccnc1)NCC3CCN(C2CCNCC2)CC3
COc2cc(c1ccccn1)nc(\C=N\O)c2SC	ZINC000000005789	c2ccc(c1ccccn1)nc2
CN(C)C(=O)CCNc1ccc(Br)cc1	ZINC000000001049	c1ccccc1
CCN(CC)CC(=O)N4CCC(c3nc2C[N@](Cc1ccccc1)CCc2c(=O)[nH]3)CC4	ZINC000019526320	O=c4[nH]c(C1CCNCC1)nc3CN(Cc2ccccc2)CCc34
CN2CCN(C(C)(C)CNCc1ccc(Br)o1)CC2	ZINC000020200331	C2CN(CCNCc1ccco1)CCN2
O[C@@H]3CN(C2CCN(Cc1ccccn1)CC2)CC[C@H]3N4CCCCCC4	ZINC000012305724	C4CCCN(C3CCN(C2CCN(Cc1ccccn1)CC2)CC3)CC4
CNC(=O)C(/NC(=O)c1ccc(N(=O)=O)cc1)=C/c2ccccc2F	ZINC000000043064	O=C(NC=Cc1ccccc1)c2ccccc2
CN5CCN(Cc4nnc(C3CCN(C[C@@H]2[C@H]1CNC[C@H]12)CC3)n4C)CC5	ZINC000102410728	C5CN(Cc4nnc(C3CCN(CC2C1CNCC12)CC3)[nH]4)CCN5
CN3CCC([N@]2CCC[C@@H](C(=O)NCCn1ccnc1C)C2)CC3	ZINC000011819364	O=C(NCCn1ccnc1)C3CCCN(C2CCNCC2)C3
C[C@@H]3CCC[N@](C[C@@H](C)NC(=O)N2CCN(c1ccncc1)CC2)C3	ZINC000056786184	O=C(NCCN1CCCCC1)N3CCN(c2ccncc2)CC3
Cc4ccc3[nH]c(=O)c(CN2CCC(n1cc(CN)nn1)CC2)cc3c4	ZINC000023507025	O=c2[nH]c1ccccc1cc2CN4CCC(n3ccnn3)CC4
Fc4ccc([C@H]3CC(=O)n2nc(c1ccc(F)cc1)nc2S3)cc4	ZINC000000079107	O=C3CC(c1ccccc1)Sc4nc(c2ccccc2)nn34
CCc1c(O)c(=O)ccn1CC	ZINC000000001220	O=c1cc[nH]cc1
Cc2c(NC(=O)c1ccco1)cc3c(c2N(=O)=O)C(C)(C)CC3(C)C	ZINC000000094271	O=C(Nc2ccc1CCCc1c2)c3ccco3
CN(C)CCNC(=O)C(=O)NC[C@@H](N(C)C)c1ccc(N(C)C)cc1	ZINC000005340228	c1ccccc1
CN5CCN(C[C@H]1C[N@@]2CC[C@H]1C[C@@H]2CNC(=O)c4ccc3OCOc3c4)CC5	ZINC000022926955	O=C(NCC1CC2CCN1CC2CN3CCNCC3)c5ccc4OCOc4c5
Cc4cn3[C@@H]2O[C@@H](COC(=O)c1ccccc1)[C@@H](O)[C@@H]2Oc3nc4=O	ZINC000000389026	O=C(OCC3CC2Oc1nc(=O)ccn1C2O3)c4ccccc4
Cc4ccc(C)c(Cc3c(C)nc2c(C(=O)NC1CC1)cnn2c3C)c4	ZINC000000217858	O=C(NC1CC1)c3cnn4cc(Cc2ccccc2)cnc34
CN[C@@]13CC=CC[C@H]1COc2ccccc23	ZINC000000012944	C2Oc1ccccc1C3CC=CCC23
Cc2cccc(Sc1cccc(N)c1C#N)c2	ZINC000000020466	S(c1ccccc1)c2ccccc2
O=C3CCC(c2ccc(n1ccnc1)cc2)=NN3	ZINC000000001553	O=C3CCC(c2ccc(n1ccnc1)cc2)=NN3
Clc2ccc(OCC(=O)Nc1cccnc1)c(Br)c2	ZINC000000036271	O=C(COc1ccccc1)Nc2cccnc2
O=C(CCn2c(=O)c1ccccc1c2=O)Nc3cccc4ccccc34	ZINC000000048070	O=C(CCn2c(=O)c1ccccc1c2=O)Nc3cccc4ccccc34
Nc2ccc(C(=O)Nc1ccccc1N)cc2	ZINC000000001310	O=C(Nc1ccccc1)c2ccccc2
C[C@@H]4Nc2nc(NC(=O)c1ccc[n+](C)c1)[nH]c(=O)c2N(C(=O)c3ccc[n+](C)c3)[C@@H]4C	ZINC000000719486	O=C(Nc3nc2NCCN(C(=O)c1cccnc1)c2c(=O)[nH]3)c4cccnc4
COc4ccc3n(CC1CC1)c(=O)nc(c2ccccc2)c3c4	ZINC000000000154	O=c3nc(c1ccccc1)c2ccccc2n3CC4CC4
COC(=O)c2nnn(c1cccc(Cl)c1)c2C(=O)OC	ZINC000000105840	c2ccc(n1ccnn1)cc2
CCc1cccc(CC)c1NC(=O)Cn2c(=O)sc3ccccc23	ZINC000000044768	O=C(Cn1c(=O)sc2ccccc12)Nc3ccccc3
O=C(N2CCC(Cc1ccccc1)CC2)c3cccnc3	ZINC000000029581	O=C(N2CCC(Cc1ccccc1)CC2)c3cccnc3
O[C@@H](CN1CCNCC1)Cn2ccnc2c4cc3CNCCn3n4	ZINC000072431174	C(CN1CCNCC1)Cn2ccnc2c4cc3CNCCn3n4
CCCN(Cc1nc(C(=O)OC)co1)C(=O)Nc2cccc(OC)c2	ZINC000000322575	O=C(NCc1ncco1)Nc2ccccc2
FC(F)(F)c2cccc(\C=C(/C#N)C(=O)NC[C@@H]1CCCO1)c2	ZINC000000037472	O=C(NCC1CCCO1)C=Cc2ccccc2
O[C@@]23Oc1ccccc1C=C2N4CCC3CC4	ZINC000000052855	C1CN4CCC1C3Oc2ccccc2C=C34
COc1ccc(OC[C@@H](O)CNCCCN(C)C)c(C(C)(C)C)c1	ZINC000003418302	c1ccccc1
COc4ccc(CNc3ccc2n(c1ccc(C)cc1)cnc2c3)cc4	ZINC000000233939	C(Nc3ccc2n(c1ccccc1)cnc2c3)c4ccccc4
Cn3c(=O)n(C)c2ncn(C[C@@H](O)CNc1ccc(F)cc1)c2c3=O	ZINC000000088448	O=c3[nH]c(=O)c2n(CCCNc1ccccc1)cnc2[nH]3
O=C(Nc2ccc(C1=NCCCN1)cc2)c5ccc(C(=O)Nc4ccc(C3=NCCCN3)cc4)nc5	ZINC000001596508	O=C(Nc2ccc(C1=NCCCN1)cc2)c5ccc(C(=O)Nc4ccc(C3=NCCCN3)cc4)nc5
Nc4c(c2ccc(C1=NCCN1)cc2)[nH]c5cc(C3=NCCN3)ccc45	ZINC000001583608	C5CN=C(c4ccc(c3cc2ccc(C1=NCCN1)cc2[nH]3)cc4)N5
CN(C)C[C@@H]1CC2(C[C@@H](CN(C)C)C1=O)OCCO2	ZINC000001717644	O=C1CCC2(CC1)OCCO2
Nc1nnnn1CC(=O)NC3(C(=O)Nc2ccccc2)CCCCC3	ZINC000000092616	O=C(Cn1cnnn1)NC3(C(=O)Nc2ccccc2)CCCCC3
COc2ccc(CCC(=O)Nc1cc(C)c(O)c(C)c1)cc2	ZINC000000007070	O=C(CCc1ccccc1)Nc2ccccc2
C[C@@H](NC2CCN(Cc1ccccc1)CC2)[C@@H](O)c3ccc(O)cc3	ZINC000009861946	C(Cc1ccccc1)NC3CCN(Cc2ccccc2)CC3
CN(C)CCC3CCN(C[C@@H](O)Cn2c(c1ccccc1)noc2=O)CC3	ZINC000067485709	O=c2onc(c1ccccc1)n2CCCN3CCCCC3
CN3CCC(NCC2CCC(CNC1CCN(C)CC1)CC2)CC3	ZINC000002004335	C3CC(NCC2CCC(CNC1CCNCC1)CC2)CCN3
CSCCNCc2ccc(OC[C@@H](O)CN1CCCCC1)cc2	ZINC000011874543	C2CCN(CCCOc1ccccc1)CC2
FC(F)(F)c3ccc(Cl)c(NC(=O)c1cccc2ccccc12)c3	ZINC000000363266	O=C(Nc1ccccc1)c2cccc3ccccc23
O=S(=O)(Nc1ncccn1)c2ccccc2	ZINC000000029133	O=S(=O)(Nc1ncccn1)c2ccccc2
COc3ccc(OCc2ccc(C(=O)Nc1nncs1)cc2)cc3	ZINC000000034281	O=C(Nc1nncs1)c3ccc(COc2ccccc2)cc3
CN4CCN([C@H]3C[N@@](Cc1c(C)cc(C)cc1n2cccn2)C[C@@H]3O)CC4	ZINC000067605316	C4CN(C3CCN(Cc1ccccc1n2cccn2)C3)CCN4
CC(C)NC(=O)c2ccc(N(Cc1ccccc1)S(C)(=O)=O)cc2	ZINC000000233809	C(Nc1ccccc1)c2ccccc2
COc1ccc(N(=O)=O)cc1NC(=O)\C=C\c2ccccc2	ZINC000000046203	O=C(Nc1ccccc1)C=Cc2ccccc2
NCCCCC[C@@H](CCN)SC[C@@H]3O[C@@H](n1cnc2c(N)ncnc12)[C@@H](O)[C@@H]3O	ZINC000005487117	C3COC(n1cnc2cncnc12)C3
CCC(=O)Nc1sc(C(=O)OC)c(C)c1C(=O)OC	ZINC000000040736	c1ccsc1
O[C@H](Cn1ccnc1)c3ccc(CCc2ccccc2)cc3	ZINC000000000207	C(Cc2ccc(CCn1ccnc1)cc2)c3ccccc3
NC(=O)CN3CCN(c1ccnc2cc(Cl)ccc12)CC3	ZINC000001607933	C3CN(c1ccnc2ccccc12)CCN3
Cc2cnc(NS(=O)(=O)c1ccc(F)cc1)c(Br)c2	ZINC000000117840	O=S(=O)(Nc1ccccn1)c2ccccc2
C[n+]1ccc(\C=N\O)cc1C(=O)NCC[N+](C)(C)C	ZINC000000520350	c1ccncc1
O=Cc2ccc1OCOc1c2	ZINC000000001953	C2Oc1ccccc1O2
CN4CCN(C(=O)CC[C@H]3CNC(=O)[C@@H]1[C@@H](CC[N@@]1C2CCOCC2)N3C)CC4	ZINC000022923476	O=C(CCC3CNC(=O)C1C(CCN1C2CCOCC2)N3)N4CCNCC4
CNC(=O)[C@@H]4C[C@@H](n3cc(c2ccc(CN1CCC[N@@](C)CC1)cc2)nn3)CN4	ZINC000067689273	C4CNCCN(Cc3ccc(c2cn(C1CCNC1)nn2)cc3)C4
Oc1ccc(Cl)cc1Nc3nc(c2ccccc2)nc4ccccc34	ZINC000000132608	N(c1ccccc1)c3nc(c2ccccc2)nc4ccccc34
Oc2ccc(\C=C\c1cc(O)cc(O)c1)cc2	ZINC000000006787	C(=Cc1ccccc1)c2ccccc2
O=c4[nH]c3c(Cc1nn[nH]n1)c2ccccc2n3c5ccccc45	ZINC000000009171	O=c4[nH]c3c(Cc1nn[nH]n1)c2ccccc2n3c5ccccc45
COc3ccc(NC(=O)\C=C\c2ccc1OCOc1c2)c(OC)c3	ZINC000000044349	O=C(Nc1ccccc1)C=Cc3ccc2OCOc2c3
Cn4c[n+](NC(=O)c3ccc(c2ccc(C(=O)N[n+]1cnn(C)c1)cc2)cc3)cn4	ZINC000006816941	O=C(N[n+]1cn[nH]c1)c4ccc(c3ccc(C(=O)N[n+]2cn[nH]c2)cc3)cc4
Cn3nc(O[C@@H]2c1cc(C#N)ccc1OC(C)(C)[C@@]2(C)O)ccc3=O	ZINC000000012426	O=c3ccc(OC1CCOc2ccccc12)n[nH]3
C[N+]2(C)CCN(C(=O)CCC(=O)N1CC[N+](C)(C)CC1)CC2	ZINC000000282351	O=C(CCC(=O)N1CCNCC1)N2CCNCC2
CC1(C)Cc3c(CO1)sc(NC(=O)Nc2ccccc2)c3C(N)=O	ZINC000000267465	O=C(Nc1ccccc1)Nc3cc2CCOCc2s3
C[C@@H](Cc1ccccc1)[N+]3(C)CC[N+](C)(c2ccccc2)CC3	ZINC000003616863	C2CN(c1ccccc1)CCN2CCc3ccccc3
Fc3ccc(CNC(=O)[C@H]2CN(C1CCCCCCC1)C(=O)C2)cc3	ZINC000000220457	O=C2CC(C(=O)NCc1ccccc1)CN2C3CCCCCCC3
CN2CCCNCCN(CCc1ccccn1)CCC[N@@](C)CC2	ZINC000022859470	C2CNCCNCCCN(CCc1ccccn1)CCNC2
C[N+]3(CCNc2cc(=O)c(NCC[N+]1(C)CCOCC1)cc2=O)CCOCC3	ZINC000001703469	O=c2cc(NCCN1CCOCC1)c(=O)cc2NCCN3CCOCC3
Nc1nnnn1/N=C/c3ccc(c2cccc(Cl)c2Cl)o3	ZINC000000051982	C(=Nn1cnnn1)c3ccc(c2ccccc2)o3
C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc3ccc2OCCOc2c3	ZINC000000269375	O=C(CSc1ccccc1)Nc3ccc2OCCOc2c3
NC(=N)c4ccc3oc(C=Cc2nc1ccc(C(N)=N)cc1[nH]2)cc3c4	ZINC000005479130	C(=Cc2nc1ccccc1[nH]2)c4cc3ccccc3o4
CC(=O)N1CCC2(CC1)OC(=O)C(C)=C2C(=O)NCCCN4CCC(N3CCCCC3)CC4	ZINC000020531861	O=C4OC1(CCNCC1)C(C(=O)NCCCN3CCC(N2CCCCC2)CC3)=C4
Nc3nc2n([C@@H]1CC[C@H](CO)O1)cnc2c(=O)[nH]3	ZINC000000024612	O=c2[nH]cnc3n(C1CCCO1)cnc23
CC[N@]1CCC[C@@H]1CN(CCC(=O)N2CCNCC2)C(=O)c3cccc(NC(C)=O)c3	ZINC000045966794	O=C(CCN(CC1CCCN1)C(=O)c2ccccc2)N3CCNCC3
Cc2nccc(N1CCN(S(C)(=O)=O)CC1)n2	ZINC000000013140	C2CN(c1ccncn1)CCN2
COc4ccc(c2c1c(=O)n(C)c(=O)n(C)c1c3cccnn23)cc4	ZINC000000106463	O=c4[nH]c(=O)c3c(c1ccccc1)n2ncccc2c3[nH]4
CCOC(=O)CCc3ccc2O[C@H](c1ccc(N(=O)=O)s1)Nc2c3	ZINC000000094482	N2C(c1cccs1)Oc3ccccc23
N#Cc3c(SCc1ccccc1)nc2CCCc2c3[C@H]4CCC=CC4	ZINC000000032618	C4Cc3nc(SCc1ccccc1)cc(C2CCC=CC2)c3C4
Clc2ccc(C(=O)Nc1ccccc1Br)c(Cl)c2	ZINC000000363881	O=C(Nc1ccccc1)c2ccccc2
O=C(CSc2nc1cccnc1[nH]2)N3CCOCC3	ZINC000000032611	O=C(CSc2nc1cccnc1[nH]2)N3CCOCC3
OC[C@@H]1CCC[N@]1Cc4cn(C3CCN(C2CCCC2)CC3)nn4	ZINC000023159309	C4CCC(N3CCC(n2cc(CN1CCCC1)nn2)CC3)C4
CC(C)NCc3cccc(OCCOc1nccnc1N2CCNCC2)c3	ZINC000001552803	C3CN(c1nccnc1OCCOc2ccccc2)CCN3
Fc2cccc(Cn1nc[nH]c1=S)c2	ZINC000000003776	S=c1[nH]cnn1Cc2ccccc2
FC(F)(F)c4ccn(c2ncnc3scc(c1ccccc1)c23)n4	ZINC000000066442	c4ccc(c2csc3ncnc(n1cccn1)c23)cc4
CSc2ccc(\C=N\c1cc(N(=O)=O)ccc1F)cc2	ZINC000000046068	C(=Nc1ccccc1)c2ccccc2
O[C@@H](COc1ccccc1CNCC2CCOCC2)CN3CCSCC3	ZINC000012072352	C(COc1ccccc1CNCC2CCOCC2)CN3CCSCC3
Clc3ccc(Cl)c(NC(=O)COc1cccc2ccccc12)c3	ZINC000000384132	O=C(COc1cccc2ccccc12)Nc3ccccc3
Cn2c(=O)n(C)c3cc(CNCC1CCNCC1)ccc23	ZINC000010434709	O=c3[nH]c2ccc(CNCC1CCNCC1)cc2[nH]3
O=C(Cn2c(=O)c1ccccc1c2=O)N4CCN(c3ccccc3)CC4	ZINC000000298307	O=C(Cn2c(=O)c1ccccc1c2=O)N4CCN(c3ccccc3)CC4
CN2C[C@H](c1cccc(O)c1)O[C@H]2C(C)(C)C	ZINC000000003796	C2NCC(c1ccccc1)O2
Brc3ccc2oc(=O)c(c1csc(CC#N)n1)cc2c3	ZINC000000193102	O=c2oc1ccccc1cc2c3cscn3
CCN(CC)Cc3cnc2c(C(=O)NCCn1ccnc1C)cnn2c3	ZINC000067515514	O=C(NCCn1ccnc1)c2cnn3cccnc23
Cc4cc(N3CCC(NCc2nc(c1cnccn1)n[nH]2)CC3)nc(N)n4	ZINC000095369088	C2CN(c1ccncn1)CCC2NCc4nc(c3cnccn3)n[nH]4
Cc1cc(C(F)(F)F)nn1CC(=O)N2CCOCC2	ZINC000000035398	O=C(Cn1cccn1)N2CCOCC2
CCOC(=O)[C@H](C1CCCCC1)C(=O)Nc2cc(N(C)C)ccc2C	ZINC000000198861	O=C(CC1CCCCC1)Nc2ccccc2
C1N6CN7CN1C[N+](Cc5ccc(C[N+]34CN2CN(CN(C2)C3)C4)cc5)(C6)C7	ZINC000019324181	C1N6CN7CN1C[N+](Cc5ccc(C[N+]34CN2CN(CN(C2)C3)C4)cc5)(C6)C7
O=C(CCc1ccccc1)N2CCC[C@H]2c4nc(c3ccccc3)no4	ZINC000000325261	O=C(CCc1ccccc1)N2CCCC2c4nc(c3ccccc3)no4
CCOC(=O)C1=CN(C(C)C)C=C(C(=O)OCC)C1c2cccs2	ZINC000000264510	N2C=CC(c1cccs1)C=C2
Cc1ccc(N(=O)=O)c2nsnc12	ZINC000000039558	c2ccc1nsnc1c2
COc2cc(OC)nc(Oc1ccc(NC(C)=O)cc1)n2	ZINC000000041464	O(c1ccccc1)c2ncccn2
O=C(NCCc2csc(c1cccnc1)n2)[C@@H]4CC3(CCNCC3)CN4	ZINC000072156323	O=C(NCCc2csc(c1cccnc1)n2)C4CC3(CCNCC3)CN4
O=C(COc1ccc(C#N)cc1)N/N=C/c3ccc2OCOc2c3	ZINC000000118039	O=C(COc1ccccc1)NN=Cc3ccc2OCOc2c3
Cn2cnc1ccc(N(=O)=O)cc1c2=O	ZINC000000032144	O=c1[nH]cnc2ccccc12
Cn3ncc(c2nc(c1cc(Cl)c(N)c(Cl)c1)no2)c3Cl	ZINC000000160119	c3ccc(c2noc(c1cn[nH]c1)n2)cc3
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)c4ccc3OCCOc3c4	ZINC000012713168	O=C(NCC2CCN(C1CCNCC1)CC2)c4ccc3OCCOc3c4
Clc3ccc(C2(Cn1cncn1)OCCO2)c(Cl)c3	ZINC000000000975	C3COC(Cn1cncn1)(c2ccccc2)O3
CCOC(=O)c2cnc1ccc(OC)cc1c2Nc3ccccc3C	ZINC000000071581	N(c1ccccc1)c2ccnc3ccccc23
CCOc3ccnc(N2CCN(C(=O)c1cccs1)CC2)n3	ZINC000000017603	O=C(N2CCN(c1ncccn1)CC2)c3cccs3
C[N+](C)(C)CCC[N+](C)(C)CCn1c(=O)c3cccc2cccc(c1=O)c23	ZINC000005045564	O=c1[nH]c(=O)c3cccc2cccc1c23
CCc1nccn1C[C@@H](C)C(=O)N4CCc3nc([C@@H]2CCNC2)ncc3C4	ZINC000019523577	O=C(CCn1ccnc1)N4CCc3nc(C2CCNC2)ncc3C4
Fc1ccccc1NC(=O)\C=C\c3ccc(OCc2ccccc2)cc3	ZINC000000131094	O=C(Nc1ccccc1)C=Cc3ccc(OCc2ccccc2)cc3
C[C@@H]3CCCN(C[C@H](O)CN2CCN(C[C@H](O)C[N@]1CCC[C@H](C)C1)[C@H](C)C2)C3	ZINC000022580050	C3CCN(CCCN2CCN(CCCN1CCCCC1)CC2)CC3
CNc2nn1nnnc1c3ccccc23	ZINC000000032545	c1ccc2c(c1)cnn3nnnc23
CN1C(=O)[C@@]3(C2=C1CC=CC2)C(C#N)=C(N)OC(C)=C3C(C)=O	ZINC000000033364	O=C2NC1=C(CC=CC1)C23C=COC=C3
O=C(Nn3c(C1CCCCC1)nc2ccccc2c3=O)c4cccnc4	ZINC000000069637	O=C(Nn3c(C1CCCCC1)nc2ccccc2c3=O)c4cccnc4
COc1ccccc1[C@H](O)c3nc2ccccc2n3Cc4ccccc4	ZINC000000266687	C(c1ccccc1)c3nc2ccccc2n3Cc4ccccc4
CCN4CCN(CC(=O)N3CC[C@@]2(CCC[N@@](CC1CC1)C2)C3)CC4	ZINC000020907468	O=C(CN1CCNCC1)N4CCC3(CCCN(CC2CC2)C3)C4
COc3ccc([C@H]1[C@@H](C(C)=O)[C@@](C)(O)Cc2noc(C)c12)cc3	ZINC000000053133	C3CC(c1ccccc1)c2conc2C3
COc1ccccc1[C@@H]4C2C(=O)CCCC2=Nc5nc3ccccc3n45	ZINC000000222562	O=C4CCCC5=Nc2nc1ccccc1n2C(c3ccccc3)C45
Cc3ccc(CCC(=O)Nc2c(C)n(C)n(c1ccccc1)c2=O)o3	ZINC000000083642	O=C(CCc1ccco1)Nc3c[nH]n(c2ccccc2)c3=O
CN3CCC(NC(=O)c1cn(C)nc1C(=O)NC2CCN(C)CC2)CC3	ZINC000036617958	O=C(NC1CCNCC1)c2c[nH]nc2C(=O)NC3CCNCC3
CC(=O)Oc1ccccc1n3c(=O)c2ccc(N(=O)=O)cc2c3=O	ZINC000000060129	O=c2n(c1ccccc1)c(=O)c3ccccc23
Cc2cc(=O)oc3ccc(OC\C(=N\O)c1ccc(Cl)cc1)cc23	ZINC000000036282	N=C(COc2ccc1oc(=O)ccc1c2)c3ccccc3
CC(C)CCNC(=O)c2cc(c1ccc(C)c(C)c1)nc3ccccc23	ZINC000000218067	c3ccc(c2ccc1ccccc1n2)cc3
C[N+](C)(C)CCOC(=O)\C=C\C(=O)OCC[N+](C)(C)C	ZINC000020275773	nonring
O=c3c1ccccc1c5c2OCOc2cc4ccnc3c45	ZINC000000006256	O=c3c1ccccc1c5c2OCOc2cc4ccnc3c45
O=C(NCCN1CCCC1)c4cc(CN3CCc2ccccc2C3)on4	ZINC000011880082	O=C(NCCN1CCCC1)c4cc(CN3CCc2ccccc2C3)on4
Cn2c(=O)[nH]c3cc1nn[nH]c1cc23	ZINC000000002428	O=c3[nH]c2cc1nn[nH]c1cc2[nH]3
FC(F)(F)c3ccc(NN[C@H]1OC(=O)c2ccccc12)c(Cl)c3	ZINC000000110632	O=C2OC(NNc1ccccc1)c3ccccc23
O=C(Cc1cccs1)Nc2nncs2	ZINC000000068457	O=C(Cc1cccs1)Nc2nncs2
CC(C)N3CCC(N2CCN(c1cc(N)ncn1)C[C@@H]2CCO)CC3	ZINC000072429499	C3CC(N2CCN(c1ccncn1)CC2)CCN3
Cc3cc[n+](CC(=O)CCc2ccc(C(=O)C[n+]1ccc(C)cc1)cc2)cc3	ZINC000001559970	O=C(CCc2ccc(C(=O)C[n+]1ccccc1)cc2)C[n+]3ccccc3
Fc2cc(Cl)c(C(=O)Nc1ccc(Br)cn1)cc2F	ZINC000000036040	O=C(Nc1ccccn1)c2ccccc2
CCN2CCN(C(=O)CCCCC(=O)N1CCN(CC)CC1)CC2	ZINC000006046521	O=C(CCCCC(=O)N1CCNCC1)N2CCNCC2
CCN(CC)CC(=O)N3CCc2nc([C@@H]1CCCNC1)ncc2C3	ZINC000019526330	C3CNCC(c2ncc1CNCCc1n2)C3
Cc2noc(c1ccc(Cl)cc1)c2C(=O)Nc3ccccc3Cl	ZINC000000120880	O=C(Nc1ccccc1)c2cnoc2c3ccccc3
CC(=O)c2ccc(NC(=S)NC(=O)c1cccc(C)c1)cc2	ZINC000000038922	O=C(NC(=S)Nc1ccccc1)c2ccccc2
CN(C)CCn3ccc(NC(=O)N2CCC[N@](Cc1cnn(C)c1)CC2)n3	ZINC000136843909	O=C(Nc1cc[nH]n1)N3CCCN(Cc2cn[nH]c2)CC3
COc1ccccc1N3CCN(C(=O)c2c(F)cccc2Cl)CC3	ZINC000000112254	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
Oc1ccc(Cl)cc1[C@]3(O)C(=O)Nc2c(C(F)(F)F)cccc23	ZINC000000021695	O=C2Nc1ccccc1C2c3ccccc3
C[C@@H]1CCC[C@@H](C(=O)OCC[N+](C)(C)C)[N+]1(C)C	ZINC000001999355	C1CCNCC1
COc2cc(NC(=O)c1c(F)cccc1F)nc(OC)n2	ZINC000000052691	O=C(Nc1ccncn1)c2ccccc2
Cc2ccc[n+](CCCCC[n+]1cccc(C)c1)c2	ZINC000001667616	C(CC[n+]1ccccc1)CC[n+]2ccccc2
Cc3ccc2ncnc(Oc1ncccc1NC(=O)C(C)(C)C)c2c3	ZINC000000079000	O(c1ccccn1)c2ncnc3ccccc23
CN(C)CCn4cnc3sc2C[C@H](NCc1ccc(F)cc1F)CCc2c3c4=O	ZINC000012039313	O=c3[nH]cnc4sc2CC(NCc1ccccc1)CCc2c34
CCOc2cccc(C(=O)Nc1cc(Cl)c(Cl)cc1Cl)c2	ZINC000000290859	O=C(Nc1ccccc1)c2ccccc2
CN(C)CCn2ccc(=O)c3cc1c(=O)ccn(CCN(C)C)c1c(C)c23	ZINC000001629464	O=c2cc[nH]c3cc1[nH]ccc(=O)c1cc23
COc3cccc([C@@H]1CNC[C@H]1c2cc(=O)[nH]c(NCCN(C)C)n2)c3	ZINC000012325629	O=c3cc(C1CNCC1c2ccccc2)nc[nH]3
COc2cc(C(=O)O/N=C/c1ccc(F)c(Cl)c1)cc(Cl)n2	ZINC000000165223	O=C(ON=Cc1ccccc1)c2ccncc2
Oc1ccccc1\C=N\n4c(c2ccccc2)nc3ccccc3c4=O	ZINC000000049119	O=c3n(N=Cc1ccccc1)c(c2ccccc2)nc4ccccc34
COc2cc(\C=N\n1c(SC)nnc(C(C)(C)C)c1=O)ccc2O	ZINC000000117093	O=c1cnncn1N=Cc2ccccc2
Nc1nonc1n2nncc2c3ccccc3	ZINC000000051767	c3ccc(c1cnnn1c2cnon2)cc3
FC(F)(F)c2cc(N[C@@H](C#N)c1ccccc1)cc(C(F)(F)F)c2	ZINC000000102314	C(Nc1ccccc1)c2ccccc2
O=N(=O)c1ccccc1\C=N\NS(=O)(=O)c2ccccc2	ZINC000000058698	O=S(=O)(NN=Cc1ccccc1)c2ccccc2
O=C(C[C@@H]1CCNC[C@@H]1Cc3cc(CN2CCNCC2)on3)NC4CC4	ZINC000022936347	O=C(CC1CCNCC1Cc3cc(CN2CCNCC2)on3)NC4CC4
Clc2cc(Cl)c(OC(=O)Nc1ccccc1)cc2Cl	ZINC000000001760	O=C(Nc1ccccc1)Oc2ccccc2
NC(=N)SCCC(=O)NCNC(=O)CCSC(N)=N	ZINC000016991091	nonring
C[N@]4CCN(c3nc(c1ccccn1)nc2CNCCc23)C[C@@H]4CCO	ZINC000072148100	C4CN(c3nc(c1ccccn1)nc2CNCCc23)CCN4
CN3CCN(C(=O)CC[C@@H]2CCC[N@](C1CCSCC1)C2)CC3	ZINC000014974395	O=C(CCC2CCCN(C1CCSCC1)C2)N3CCNCC3
CN3CCC[N@](C[C@@H]2CN(c1cc(C)nc(N(C)C)n1)C[C@@H]2CO)CC3	ZINC000091873053	C3CNCCN(CC2CCN(c1ccncn1)C2)C3
Oc1ccccc1C(=O)c2cccs2	ZINC000000006650	O=C(c1ccccc1)c2cccs2
CCn1nccc1C(=O)n2nc(C)c(Cl)c2C	ZINC000000037397	O=C(c1ccn[nH]1)n2cccn2
COc2ccc([C@@H](O)CN1CCC(N)CC1)cc2OC	ZINC000011729535	C2CCN(CCc1ccccc1)CC2
O[C@]4(c1cccc(Cl)c1)C2=NCCCN2c3ccccc34	ZINC000000000142	C4CN=C3C(c1ccccc1)c2ccccc2N3C4
CC(C)N(Cc1ccc(N(C)C)cc1)C(=S)Nc2ccc(F)cc2	ZINC000000067474	S=C(NCc1ccccc1)Nc2ccccc2
COC[C@@H]3CN(c2ccc(OCc1cccc(C#N)c1)cc2)C(=O)O3	ZINC000000000149	O=C1OCCN1c3ccc(OCc2ccccc2)cc3
C[C@@H](O)CN3CCC(CNCc1nnnn1C2CC2)CC3	ZINC000069846487	C3CC(CNCc1nnnn1C2CC2)CCN3
CCOC(=O)Cn2c1ccccc1n3nc(C)c(=O)nc23	ZINC000000052840	O=c1cnn3c(n1)[nH]c2ccccc23
CCc1nccn1CCC(=O)N[C@@H]3CCC[N@@](CCc2ccccc2)C3	ZINC000011662190	O=C(CCn1ccnc1)NC3CCCN(CCc2ccccc2)C3
COc2ccc1[nH]c(=O)c(=O)[nH]c1n2	ZINC000000007790	O=c2[nH]c1cccnc1[nH]c2=O
Clc3ccc(C(=O)C[C@@H](Sc1ccccc1)c2ccco2)cc3	ZINC000000064800	O=C(CC(Sc1ccccc1)c2ccco2)c3ccccc3
C[C@H]1CC(=O)NN=C1c2ccc(NN=C(C#N)C#N)cc2	ZINC000000004689	O=C2CCC(c1ccccc1)=NN2
COCCc3noc(CN(C)C(=O)[C@@H]2CC1(CCNCC1)C[N@]2C)n3	ZINC000072424382	O=C(NCc1ncno1)C3CC2(CCNCC2)CN3
C3Cc2cccc(NC1=NCCN1)c2C3	ZINC000000001563	C3Cc2cccc(NC1=NCCN1)c2C3
Cc1[nH]c(=O)c(C#N)cc1c2ccc(C#N)cc2	ZINC000000004044	O=c2ccc(c1ccccc1)c[nH]2
CN(C)CCC(CCN(C)C)=NOC(=O)c1ccccc1	ZINC000005891981	c1ccccc1
COc2ccc(NC(=O)c1ccc(Cl)cc1Cl)c3ccccc23	ZINC000000263537	O=C(Nc1cccc2ccccc12)c3ccccc3
C[C@H]2CC(=O)N1CCSC1=N2	ZINC000000000560	O=C1CCN=C2SCCN12
COc4ccc(c2[nH]c1ccccc1c2c3ccc(OC)cc3)cc4	ZINC000000001568	c4ccc(c2[nH]c1ccccc1c2c3ccccc3)cc4
Cn1nnnc1SC(c2ccccc2)c3ccccc3	ZINC000000036163	S(C(c1ccccc1)c2ccccc2)c3nnn[nH]3
COc2ccc1ccc(=O)oc1c2CC=C(C)C	ZINC000000000566	O=c2ccc1ccccc1o2
CN(C)c2ccc(C(=O)NCc1ccc(C)cc1)cc2	ZINC000000030048	O=C(NCc1ccccc1)c2ccccc2
COc2cc1ccccc1cc2C(=O)NCc3cccnc3	ZINC000000029048	O=C(NCc1cccnc1)c3ccc2ccccc2c3
CCc3c(C)c(C#N)c2nc1ccccc1n2c3Nc4ccccc4	ZINC000000045597	N(c1ccccc1)c3cccc4nc2ccccc2n34
CCOc1ccccc1NC(=O)c2ccc(N(C)C)cc2	ZINC000000030040	O=C(Nc1ccccc1)c2ccccc2
CN(C)CCN2C[C@H](C(=O)NCCn1ccnc1C)CCC2=O	ZINC000012445797	O=C2CCC(C(=O)NCCn1ccnc1)CN2
N[C@H](CC(O)=O)c2ccc(OCc1ccccc1)cc2	ZINC000000031181	C(Oc1ccccc1)c2ccccc2
NS(=O)(=O)c3cc([C@]2(O)NC(=O)c1ccccc12)ccc3Cl	ZINC000000020253	O=C2NC(c1ccccc1)c3ccccc23
C[C@@]12O[C@@](C)(C=C1)[C@@H]4[C@H]2C(=O)N(c3ccc(Br)cc3)C4=O	ZINC000000275629	O=C3C2C1OC(C=C1)C2C(=O)N3c4ccccc4
Clc3ccc(C(=O)Nn2c(=O)c1ccccc1c2=O)c(Cl)c3	ZINC000000046210	O=C(Nn2c(=O)c1ccccc1c2=O)c3ccccc3
CCC(=O)OC(C[N+]1(C)CCCCC1)C[N+]2(C)CCCCC2	ZINC000000509853	C2CCN(CCCN1CCCCC1)CC2
NCCCC(=O)N2CN1CN(C(=O)CCCN)CC(N(=O)=O)(C1)C2	ZINC000003147639	C1NCN2CNCC1C2
COC(=O)C2=CS[C@H]1CC(=O)N12	ZINC000000005970	O=C2CC1SC=CN12
Nc4ccc(c2nncc3cc1OCOc1cc23)cc4	ZINC000000006937	C4Oc3cc2cnnc(c1ccccc1)c2cc3O4
OCCn3nnc(c2ccc(OCc1ccccc1)cc2)n3	ZINC000000011281	C(Oc2ccc(c1nn[nH]n1)cc2)c3ccccc3
O[C@H](COc1ccccc1CNCCN2CCOC2=O)C[N@]4CCc3ccccc3C4	ZINC000012459123	O=C1OCCN1CCNCc2ccccc2OCCCN4CCc3ccccc3C4
CN(C)C(=O)O[C@H]2CCC[N+](C)(CCC[N+]1(C)CCC[C@H](OC(=O)N(C)C)C1)C2	ZINC000005046555	C2CCN(CCCN1CCCCC1)CC2
CCOc2ccc(C=c1c(=O)n(C)c(=S)n(C)c1=O)c(OCC)c2	ZINC000000105312	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2ccccc2
CCc4nc(NN1CCN(C)CC1)c3oc2ccccc2c3n4	ZINC000005195040	C4CN(Nc2ncnc3c1ccccc1oc23)CCN4
CNCc2cc(N(C)C)nc([C@@H]1CCCN1C(=O)CN(C)C)n2	ZINC000019760491	C2CNC(c1ncccn1)C2
CCc3ccc(C(=O)C[C@@H]1OC(=O)c2c(OC)c(OC)ccc12)cc3	ZINC000000031396	O=C(CC1OC(=O)c2ccccc12)c3ccccc3
Cn4c(SCc2ccc1OCOc1c2)nc3ccccc3c4=O	ZINC000000032725	O=c3[nH]c(SCc2ccc1OCOc1c2)nc4ccccc34
COC(=O)c2cc(NS(=O)(=O)c1ccccc1)cc(C(=O)OC)c2	ZINC000000102623	O=S(=O)(Nc1ccccc1)c2ccccc2
CCCN1CCC4(CC1)NC(=O)N([C@@H]3CCN(C(=O)Cn2ccnc2C(C)C)C3)C4=O	ZINC000019700743	O=C(Cn1ccnc1)N4CCC(N3C(=O)NC2(CCNCC2)C3=O)C4
COc3ccc2c(CN1CCCCC1)nnc(NN)c2c3	ZINC000005640457	C3CCN(Cc1nncc2ccccc12)CC3
CC(C)[N@]3CC[C@H](CNC(=O)N2CCN(c1ccncc1)CC2)C3	ZINC000065441867	O=C(NCC1CCNC1)N3CCN(c2ccncc2)CC3
Fc5ccc(NC(=O)[C@@H]2CC3c1ccccc1C2c4ccccc34)cc5	ZINC000000335392	O=C(Nc1ccccc1)C3CC4c2ccccc2C3c5ccccc45
CN(C)Cn2cc(CC(=O)N1CCN(C)CC1)c3ccccc23	ZINC000020647808	O=C(Cc1c[nH]c2ccccc12)N3CCNCC3
CC(C)C(=O)Oc3ccc(NC1=NS(=O)(=O)c2ccccc12)cc3	ZINC000000077279	O=S3(=O)N=C(Nc1ccccc1)c2ccccc23
CC(=O)Oc2ccc1ccccc1c2\C=N\c3cc(N(=O)=O)ccc3C	ZINC000000224500	C(=Nc1ccccc1)c2cccc3ccccc23
CN(C)Cc4ccc(C[N@]3CCc2nc(c1ccccn1)[nH]c(=O)c2C3)cc4	ZINC000012122591	O=c4[nH]c(c1ccccn1)nc3CCN(Cc2ccccc2)Cc34
CC(=O)Oc3cccc(\C=c2/nc(c1ccc(Cl)cc1)oc2=O)c3	ZINC000000047451	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
Cc3cc2c(=O)c1c[nH]c(=O)cc1c(=O)c2o3	ZINC000000025758	O=c3cc2c(=O)c1occc1c(=O)c2c[nH]3
COC(=O)C(CC#CCN1CCCC1)CC#CCN2CCCC2	ZINC000005526117	C(CC#CCN1CCCC1)CC#CCN2CCCC2
Cc3c(OC(=O)c1ccco1)ccc4c(c2ccccc2)cc(=O)oc34	ZINC000000090979	O=C(Oc3ccc2c(c1ccccc1)cc(=O)oc2c3)c4ccco4
Nc1cn(CC#N)c(=O)n1c2ccc(Cl)cc2	ZINC000000001815	O=c1[nH]ccn1c2ccccc2
O=C(N2CCC[N@@](Cc1cccnc1)CC2)c4cn(C3CCNCC3)nn4	ZINC000082100265	O=C(N2CCCN(Cc1cccnc1)CC2)c4cn(C3CCNCC3)nn4
Nc2nc(N1CCCCC1)c(F)c(N)n2=O	ZINC000000016415	O=n2ccc(N1CCCCC1)nc2
COc2ccc(C(=O)Nc1nn[nH]n1)c(OC(C)C)c2	ZINC000000024979	O=C(Nc1nn[nH]n1)c2ccccc2
CCOC(=O)c3[nH]c(C)c(c2csc(NC(=O)C1CC1)n2)c3C	ZINC000000034411	O=C(Nc2nc(c1cc[nH]c1)cs2)C3CC3
O=C5CN(CC(=O)N(CC3CCN(C2Cc1ccccc1C2)CC3)C[C@@H]4CCCO4)N=[O+]5	ZINC000019782275	O=C5CN(CC(=O)N(CC3CCN(C2Cc1ccccc1C2)CC3)CC4CCCO4)N=[O+]5
C[N@@](CCO)Cc3c(C(=O)N2CCN(C1CCCCC1)CC2)nc4ccccn34	ZINC000019148908	O=C(N2CCN(C1CCCCC1)CC2)c4cn3ccccc3n4
Cc2nc1C(=C)CSCc1c(=O)[nH]2	ZINC000000025974	C=C1CSCc2c1nc[nH]c2=O
O=c2[nH]cnc1CCSCc12	ZINC000000025972	O=c2[nH]cnc1CCSCc12
CN3CCN([C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNCc2ccc(F)cc2)CC3	ZINC000020465189	C3CN(C1CCOC1CNCc2ccccc2)CCN3
CC(=O)O[C@@H]1CC[C@H]([N+](C)(C)C)[C@@H](OC(C)=O)[C@@H]1[N+](C)(C)C	ZINC000015218814	C1CCCCC1
Cc2sc(NC(=O)c1ccc(Br)o1)c(C(N)=O)c2C	ZINC000000035659	O=C(Nc1cccs1)c2ccco2
O=C(N(Cc1ccccc1)Cc2ccccc2)c3ccc(=O)[nH]c3	ZINC000000003542	O=C(N(Cc1ccccc1)Cc2ccccc2)c3ccc(=O)[nH]c3
Cn3c(=O)n(C)c2nc(Nc1ccccc1)n(CCO)c2c3=O	ZINC000000032603	O=c3[nH]c(=O)c2[nH]c(Nc1ccccc1)nc2[nH]3
C[C@@H]1CCc3c(C1)sc(NC(=O)c2ccccc2C)c3C#N	ZINC000000035654	O=C(Nc2cc1CCCCc1s2)c3ccccc3
CN(C1CCCCC1)S(=O)(=O)Cc2ccccc2	ZINC000000029850	O=S(=O)(Cc1ccccc1)NC2CCCCC2
CC(=O)Oc3ccc2c(=O)c(c1ccccc1)c(C(F)(F)F)oc2c3	ZINC000000189942	O=c2c(c1ccccc1)coc3ccccc23
C[n+]1ccccc1C(=O)NCCCNC(=O)c2cccc[n+]2C	ZINC000001875455	O=C(NCCCNC(=O)c1ccccn1)c2ccccn2
CCN4CCN(C(=O)Cn2c1CC[N@@](C(C)C)Cc1c3ccccc23)CC4	ZINC000007450220	O=C(Cn2c1CCNCc1c3ccccc23)N4CCNCC4
Cc1ccccc1CN4CCC(N3CCC(C(=O)N[C@H]2CCCCNC2=O)CC3)CC4	ZINC000015068408	O=C1NCCCCC1NC(=O)C4CCN(C3CCN(Cc2ccccc2)CC3)CC4
C[N@]2CC[C@@H]1CN3CCc4cccc([C@@H]1C2)c34	ZINC000000016077	C2CC1CN3CCc4cccc(C1CN2)c34
Cc5cc(N3CCN(c2cc(N1CCN(CCO)CC1)ccc2N(=O)=O)CC3)c4ccccc4n5	ZINC000009720426	C5CN(c4cccc(N3CCN(c1ccnc2ccccc12)CC3)c4)CCN5
CCN(CC)CCN3C=C(O)C(c2nc1ccc(C)cc1[nH]2)C3=N	ZINC000005182890	N=C1NC=CC1c3nc2ccccc2[nH]3
COc2ccc(NC(=O)[C@H]1[C@@H](C=C(Cl)Cl)C1(C)C)cc2	ZINC000000042012	O=C(Nc1ccccc1)C2CC2
NCCNc2cc(c1ccccc1)nc3ccccc23	ZINC000004336321	c3ccc(c2ccc1ccccc1n2)cc3
CN(C)CCC(=O)C(=Cc1cccs1)C(=O)CCN(C)C	ZINC000001585819	c1ccsc1
O=C(NCCCN1CCCC1)NCc3ccc(CN2CCOCC2)cc3	ZINC000011417128	O=C(NCCCN1CCCC1)NCc3ccc(CN2CCOCC2)cc3
C6CN=C(c5ccc4[nH]c(Cc3nc2ccc(C1=NCCN1)cc2[nH]3)nc4c5)N6	ZINC000005974304	C6CN=C(c5ccc4[nH]c(Cc3nc2ccc(C1=NCCN1)cc2[nH]3)nc4c5)N6
CCCC(=O)Nc2ccc(Oc1cccc(F)c1)cc2	ZINC000000024155	O(c1ccccc1)c2ccccc2
Clc3ccc(c2cn1ccsc1n2)cc3	ZINC000000023689	c3ccc(c2cn1ccsc1n2)cc3
CS(=O)(=O)Nc2cc1CCC(=O)c1cc2Sc3cccs3	ZINC000000018924	O=C2CCc3ccc(Sc1cccs1)cc23
COc2ccc(c1nnc(N)s1)cc2	ZINC000000064572	c2ccc(c1nncs1)cc2
COc4ccc(C[N@]3C[C@@H](CN1CCCC1)C[C@@H](C(=O)NC[C@@H]2CCCO2)C3)cc4OC	ZINC000014742186	O=C(NCC1CCCO1)C4CC(CN2CCCC2)CN(Cc3ccccc3)C4
O[C@@H](CN2CCC(N[C@@H]1CCCC[C@@H]1O)CC2)Cn3ccc4ccccc34	ZINC000004299560	C4CCC(NC3CCN(CCCn1ccc2ccccc12)CC3)CC4
O=C(CCN1CCCCCCC1)N3CCN(C2CCOCC2)CC3	ZINC000055370168	O=C(CCN1CCCCCCC1)N3CCN(C2CCOCC2)CC3
COc3ccc(Nc1ncnc2[nH]cnc12)cc3	ZINC000000032156	N(c1ccccc1)c2ncnc3[nH]cnc23
COC(=O)C3[C@@H](c1ccccn1)n2nnnc2N=C3C	ZINC000000071027	C2C=Nc1nnnn1C2c3ccccn3
Cc4ccc(\C=c3/nc(c1c(C)onc1c2ccccc2)oc3=O)cc4	ZINC000000178433	O=c3oc(c1conc1c2ccccc2)nc3=Cc4ccccc4
Cc4cc(N2CCN(C(=O)c1cnccn1)CC2)cc([C@@H]3CCNC3)n4	ZINC000019739126	O=C(N3CCN(c2ccnc(C1CCNC1)c2)CC3)c4cnccn4
COc2ccc1cc([C@H](C)NC(=O)NO)ccc1c2	ZINC000000012347	c2ccc1ccccc1c2
CCOC(=O)c2cnc(S/C=C/C(=O)c1ccc(F)cc1)nc2N	ZINC000000174238	O=C(C=CSc1ncccn1)c2ccccc2
CC(=O)Nc1cc(O)ccc1O	ZINC000000014819	c1ccccc1
CN5CCN(c4nnc(n1cccc1CN3CCC(N2CCCCC2)CC3)s4)CC5	ZINC000021880788	C5CCN(C4CCN(Cc1cccn1c3nnc(N2CCNCC2)s3)CC4)CC5
COc1cc(NC(=O)[C@@H](N)CCCNC(N)=N)cc2ccccc12	ZINC000002522629	c2ccc1ccccc1c2
CCN3CCN(c2ccc(C(=O)NCC[C@@H]1CCCC[N@]1C)cn2)CC3	ZINC000011841149	O=C(NCCC1CCCCN1)c3ccc(N2CCNCC2)nc3
CN(/N=C/C(C)=N\N(C)C1=NCCCCN1)C2=NCCCCN2	ZINC000005502802	C2CCN=C(NN=CC=NNC1=NCCCCN1)NC2
CN(C)C[C@@]3(O)CCN(c2nccc(N1CCC(O)CC1)n2)C3	ZINC000072453482	C3CCN(c2ccnc(N1CCCC1)n2)CC3
CCOc1ccccc1[C@@H]2NC(=S)N=C(C)C2C(=O)OCC(C)C	ZINC000000044536	S=C2NC(c1ccccc1)CC=N2
Cc3ccc(OCc2nnc(NC(=O)c1ccc(F)cc1)s2)cc3	ZINC000000178726	O=C(Nc2nnc(COc1ccccc1)s2)c3ccccc3
CN(C)CCN(C)c3nc(N(C)C)nc2C[N@](Cc1ccccc1)CCc23	ZINC000012325500	C2Cc1cncnc1CN2Cc3ccccc3
COCCNc3nc1CCNCCc1c(N2CCCNCC2)n3	ZINC000072412395	C3CNCCN(c2ncnc1CCNCCc12)C3
CCNc2nc(C#N)nc(N1CCCCC1)n2	ZINC000000033737	C2CCN(c1ncncn1)CC2
CC(C=NN2C(c1ccco1)N=NC2=S)=Cc3ccco3	ZINC000000028895	S=C2N=NC(c1ccco1)N2N=CC=Cc3ccco3
CC(C)CN3CCC([C@@H]2CCN(C(=O)Cn1ccnc1C)C2)CC3	ZINC000015077302	O=C(Cn1ccnc1)N3CCC(C2CCNCC2)C3
COc3ccc(\C=C2/CC(C)C/C(=C/c1ccc(OC)cc1)C2=O)cc3	ZINC000000069991	O=C2C(=Cc1ccccc1)CCCC2=Cc3ccccc3
CCN3CCN(c2nnc(n1cccc1C(=O)NCCN(C)C)s2)CC3	ZINC000007006091	C3CN(c2nnc(n1cccc1)s2)CCN3
CC1(C)CC2(CC(C)(C)N1)OC(=O)OC2=C	ZINC000000053017	C=C1OC(=O)OC12CCNCC2
CCOC(=O)c1n[nH]cc1C[N@@](C)CC3CCN(CCc2ccc(F)cc2)CC3	ZINC000012300282	C2CN(CCc1ccccc1)CCC2CNCc3cn[nH]c3
COc1cc(CNCC=C)ccc1OC[C@@H](O)CN2CCC(O)CC2	ZINC000014968421	C2CCN(CCCOc1ccccc1)CC2
CCc2nn(C1CCCC1)c4c2CCn5c(c3ccsc3)nnc45	ZINC000000021911	C5CCC(n4ncc3CCn2c(c1ccsc1)nnc2c34)C5
CCOC(=O)Cc3csc4nc2sc1CCCCc1c2c(=O)n34	ZINC000000067611	O=c3c2c1CCCCc1sc2nc4sccn34
Cn3c(=O)n(C)c2n(C)c(=O)c(c1ccccc1)c(O)c2c3=O	ZINC000000086198	O=c3[nH]c(=O)c2cc(c1ccccc1)c(=O)[nH]c2[nH]3
COc4ccc3oc(c1ccccc1)c(C(=O)N2CCCCC2)c3c4	ZINC000000045105	O=C(N1CCCCC1)c3c(c2ccccc2)oc4ccccc34
COc2cc(S(=O)(=O)N1CCC(C)CC1)ccc2Cl	ZINC000000036383	O=S(=O)(N1CCCCC1)c2ccccc2
CC(C)[C@@](O)(c2cccc(c1ccc(F)cc1)c2)c3cnc[nH]3	ZINC000000009012	C(c2cccc(c1ccccc1)c2)c3cnc[nH]3
Clc2ccc(/C=C/C(=O)Nc1ccc(Br)cc1)cc2	ZINC000000063940	O=C(Nc1ccccc1)C=Cc2ccccc2
C[C@@H](CC[C@H](C)[n+]1cccc(C(C)=O)c1)[n+]2cccc(C(C)=O)c2	ZINC000001666330	C(CC[n+]1ccccc1)C[n+]2ccccc2
C[N@]3C[C@H]1CNC[C@@]1(C(=O)NCCOc2nonc2C)C3	ZINC000065453460	O=C(NCCOc1cnon1)C23CNCC2CNC3
Cn2c(=O)cc4c1ccccc1c(=O)c3cccc2c34	ZINC000000027304	O=c2cc4c1ccccc1c(=O)c3cccc([nH]2)c34
COc1ccc(N(=O)=O)cc1NN=C(C#N)C#N	ZINC000000046484	c1ccccc1
O=C2[C@@H](CN1CCCC1)CCC[C@@H]2CN3CCCC3	ZINC000001640637	O=C2C(CN1CCCC1)CCCC2CN3CCCC3
O=C(C1=NNC[C@H]1c3ccc2OCOc2c3)c5ccc4ccccc4c5	ZINC000000085966	O=C(C1=NNCC1c3ccc2OCOc2c3)c5ccc4ccccc4c5
C[N+](C)(C)C[C@@H]2CO[C@H](CC[C@@H]1OC[C@H](C[N+](C)(C)C)O1)O2	ZINC000005764651	C2COC(CCC1OCCO1)O2
COC(=O)c1ccccc1NS(=O)(=O)c3ccc2OCCOc2c3	ZINC000000319379	O=S(=O)(Nc1ccccc1)c3ccc2OCCOc2c3
COC(=O)C3[C@@H](c1cc(OC)cc2ccccc12)NC(=O)N=C3C	ZINC000000044405	O=C3NC(c1cccc2ccccc12)CC=N3
CSc4cccc(NC(=O)NC[C@H]1C[C@@H]2CCN1C[C@@H]2CN3CCOCC3)c4	ZINC000012601836	O=C(NCC1CC2CCN1CC2CN3CCOCC3)Nc4ccccc4
Clc3ccc(\C=N\N=C(/C(=O)c1ccccc1)c2ccccc2)cc3	ZINC000000067728	O=C(C(=NN=Cc1ccccc1)c2ccccc2)c3ccccc3
CN(C)CCNC(=O)c3cc2CN(C(=O)C[C@@H]1CNCCO1)CCn2n3	ZINC000067965361	O=C(CC1CNCCO1)N3CCn2nccc2C3
CC(C)(Oc1ccc(Cl)cc1)C(=O)OCc2cccnc2	ZINC000000001796	O=C(COc1ccccc1)OCc2cccnc2
Clc1ccccc1C(=O)n2c(=O)sc3ccccc23	ZINC000000041116	O=C(c1ccccc1)n2c(=O)sc3ccccc23
Nc2ncnc3n([C@H]1C=C(CO)[C@H](O)[C@@H]1O)cnc23	ZINC000000001793	C3CC(n1cnc2cncnc12)C=C3
Nc2c1CCCCc1nc3cc(F)ccc23	ZINC000000010124	C3CCc2nc1ccccc1cc2C3
CNCc2c(N1CCN(C)CC1)nc3sccn23	ZINC000035429616	C3CN(c2cn1ccsc1n2)CCN3
CCn3nc(C(=O)N1CCC[N@@](C)CC1)c2C[C@H](NCC(C)C)CCc23	ZINC000020999669	O=C(N1CCCNCC1)c3n[nH]c2CCCCc23
O=C(CCC3CCN(C2CCN(Cc1ccccc1)CC2)CC3)N4CCOCC4	ZINC000012718435	O=C(CCC3CCN(C2CCN(Cc1ccccc1)CC2)CC3)N4CCOCC4
CCc2ccc(OC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl)cc2	ZINC000000038628	O=C(COc1ccccc1)Oc2ccccc2
O=C(C[C@H]3[N@](C2Cc1ccccc1C2)CCNC3=O)N5CCC(N4CCSCC4)CC5	ZINC000012440164	O=C(CC3N(C2Cc1ccccc1C2)CCNC3=O)N5CCC(N4CCSCC4)CC5
Cn4c(=O)n(C)c3nc2oc(c1ccc(F)cc1)cn2c3c4=O	ZINC000000085741	O=c4[nH]c(=O)c3c(nc2oc(c1ccccc1)cn23)[nH]4
COc3ccc([C@@H]1NC(=N)NC(=N)N1c2ccccc2)cc3OC	ZINC000003189610	N=C3NC(c1ccccc1)N(c2ccccc2)C(=N)N3
Oc2ccc1C4=[N+](CCc1c2)[C@H]3CCC[C@@H]3CC4	ZINC000000000685	C4CC3CCC1=[N+](CCc2ccccc12)C3C4
CCN(CC)CCNc2ncc(C)c3n(C)c1ccc(OC)cc1c23	ZINC000005139322	c1ccc3c(c1)[nH]c2ccncc23
Cc4ccc(C(=O)Nc3cccc(c2nc1ncccc1o2)c3C)cc4	ZINC000000184338	O=C(Nc3cccc(c2nc1ncccc1o2)c3)c4ccccc4
O=[S@](Cc1ccccn1)c3nc2ccccc2[nH]3	ZINC000000000778	O=S(Cc1ccccn1)c3nc2ccccc2[nH]3
COC(=O)c3ccc(\C=c2\nc(c1ccc(Cl)cc1)oc2=O)cc3	ZINC000000063376	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
CSc3nc2c1ccccc1n(C(C)=O)c2n3Cc4ccccc4	ZINC000000054277	C(c1ccccc1)n3cnc4c2ccccc2[nH]c34
CCCC(=O)NOCc1cccc2ccc(OC)cc12	ZINC000000021040	c2ccc1ccccc1c2
CCOC(=O)c1c(C)n(CCO)c2ccc(OC(C)=O)cc12	ZINC000000036700	c2ccc1[nH]ccc1c2
S=C2NCC[C@@H](COc1ccccc1)O2	ZINC000000000771	S=C2NCCC(COc1ccccc1)O2
Cn1nc(C(F)(F)F)cc1C(=O)Nc2ccc(Br)cn2	ZINC000000215016	O=C(Nc1ccccn1)c2ccn[nH]2
C(Nc1nonc1c2ncon2)n3nnc4ccccc34	ZINC000000045612	C(Nc1nonc1c2ncon2)n3nnc4ccccc34
CCOC(=O)C1=C(C)N(C)C(C)=C(C(=O)OCC)C1c2ccccn2	ZINC000000036494	N2C=CC(c1ccccn1)C=C2
COc2ncnc(Sc1ccc(Cl)cc1)c2N(=O)=O	ZINC000000040225	S(c1ccccc1)c2ccncn2
FC(F)(F)c1ccccc1NC(=O)CCSc2ccccc2	ZINC000000036568	O=C(CCSc1ccccc1)Nc2ccccc2
NC(=N)c3ccc(c2coc(c1ccc(C(N)=N)cc1)c2)cc3	ZINC000006536320	c3ccc(c2coc(c1ccccc1)c2)cc3
COc1ccc(\C=N\NS(C)(=O)=O)cc1OC	ZINC000000029079	c1ccccc1
Nc4ccc3nc(SCC(=O)N1CCc2ccccc12)sc3c4	ZINC000000052830	O=C(CSc2nc1ccccc1s2)N3CCc4ccccc34
CN2CCC(NC[C@@H](O)Cn1cc(N(=O)=O)cn1)CC2	ZINC000037887435	C(CNC1CCNCC1)Cn2cccn2
CC2(C)C(C(=O)N[C@H](C(N)=O)c1ccccc1)C2(C)C	ZINC000000020318	O=C(NCc1ccccc1)C2CC2
Fc3cccc(N2[C@H](c1ccc(Cl)cc1Cl)SCC2=O)c3	ZINC000000180035	O=C2CSC(c1ccccc1)N2c3ccccc3
CN(C)[C@H]3CCc2[nH]c1ccccc1c2C3	ZINC000000000192	C1CCc2c(C1)[nH]c3ccccc23
Cc4ccc(N1CCn2c1nc3n(C)c(=O)[nH]c(=O)c23)cc4	ZINC000000041935	O=c4[nH]c(=O)c3n2CCN(c1ccccc1)c2nc3[nH]4
Cc4ccc(n2cnc3cc(C(=O)NC[C@@H]1CCCO1)ccc23)c(C)c4	ZINC000000216272	O=C(NCC1CCCO1)c4ccc3n(c2ccccc2)cnc3c4
Cc2nn(c1ccccc1)nc2C(=O)Nc3cc(Cl)cc(Cl)c3	ZINC000000166207	O=C(Nc1ccccc1)c3cnn(c2ccccc2)n3
Clc2cc(Cl)c(NC(=O)NCc1ccco1)c(Cl)c2	ZINC000000040530	O=C(NCc1ccco1)Nc2ccccc2
C[N+]4(CCC[N+]13CCC(CC1)[C@@H](Cc2ccccc2)C3)CCCC4	ZINC000003622916	C4CCN(CCC[N+]13CCC(CC1)C(Cc2ccccc2)C3)C4
CN1C[C@H]2C[C@@H]1CN2c3cnccn3	ZINC000000020795	C1NC3CC1N(c2cnccn2)C3
C[N+](C)(C)CCOc1cc(OCC[N+](C)(C)C)ncn1	ZINC000000541667	c1cncnc1
CCOC(=O)[C@H](C)Sc2ncnc3sc(c1ccccc1)cc23	ZINC000000132281	c3ccc(c2cc1cncnc1s2)cc3
COc3ccc(CNCC1(C)COC1)c(OC[C@@H](O)CN2CCCC2)c3	ZINC000015075987	C3CCN(CCCOc1ccccc1CNCC2COC2)C3
CC(=O)NC[C@@H]4CCC3(CCN(Cc2cc1CNCCCn1n2)CC3)O4	ZINC000072164678	C4CNCc3cc(CN2CCC1(CCCO1)CC2)nn3C4
C[C@@H]1CC[C@@H](C)N1CCN3CCN(Cc2cn(C)c(=O)n(C)c2=O)CC3	ZINC000092665944	O=c3[nH]cc(CN2CCN(CCN1CCCC1)CC2)c(=O)[nH]3
CC(=O)Nc2ccc(NC(=O)c1nn(C)cc1Br)cc2	ZINC000000053318	O=C(Nc1ccccc1)c2cc[nH]n2
Cc3nc(c1ccccc1)c(c2ccncc2)o3	ZINC000000020049	c3ccc(c1ncoc1c2ccncc2)cc3
Cn3cc[n+](c2cccc([n+]1ccn(C)c1)c2C#N)c3	ZINC000001399830	c3cc([n+]1cc[nH]c1)cc([n+]2cc[nH]c2)c3
CCOC(=O)N2CCN(C(=O)CSc1ccccc1)CC2	ZINC000000037727	O=C(CSc1ccccc1)N2CCNCC2
COc1cc(SC)ccc1C(=O)N3CCN(c2ccccc2)CC3	ZINC000000030416	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
NN=C(N)SCCCCCCSC(N)=NN	ZINC000017290066	nonring
Cc1c(Cl)cccc1N3C[C@@H](C(=O)Nc2nccs2)CC3=O	ZINC000000034134	O=C2CC(C(=O)Nc1nccs1)CN2c3ccccc3
CCOC(=O)c3ccc(c2ccc(\C=c1\[nH]c(=O)[nH]c1=O)o2)cc3	ZINC000000034136	O=c3[nH]c(=O)c(=Cc2ccc(c1ccccc1)o2)[nH]3
C5CCC(N4CCN(c3nnc(n1cccc1CNCCCN2CCOCC2)s3)CC4)CC5	ZINC000009265763	C5CCC(N4CCN(c3nnc(n1cccc1CNCCCN2CCOCC2)s3)CC4)CC5
Cn1ccnc1Sc2nnnn2c3ccccc3	ZINC000000034394	S(c1ncc[nH]1)c2nnnn2c3ccccc3
CS(=O)(=O)N(Cc1ccccc1)Cc2ccccc2	ZINC000000029206	C(NCc1ccccc1)c2ccccc2
C4CNC[C@@H](CCc3nc(N1CCCC1)nc2CCNCc23)C4	ZINC000019015012	C4CNCC(CCc3nc(N1CCCC1)nc2CCNCc23)C4
COc3cc(\C=c2\sc(N1CCCCC1)nc2=O)ccc3O	ZINC000000039155	O=c2nc(N1CCCCC1)sc2=Cc3ccccc3
CN3OCC(=O)N(C(c1ccccc1)c2ccccc2)C3=S	ZINC000000003152	O=C1CONC(=S)N1C(c2ccccc2)c3ccccc3
CN(C)CCN(C)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CN(C)C	ZINC000020464998	C1CCOC1
C\C(Cl)=C\CSc2nc1n(C)c(=O)[nH]c(=O)c1n2CC=C	ZINC000000191460	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
COc3ccc(n2c(C)nc1ccc(Br)cc1c2=O)cc3	ZINC000000051891	O=c2n(c1ccccc1)cnc3ccccc23
CS(=O)(=O)c2cnc(N1CCC(N)CC1)nc2[C@@H]3CCCNC3	ZINC000072430063	C3CCN(c2nccc(C1CCCNC1)n2)CC3
NC(=N)Sc2nc1ccccc1nc2SC(N)=N	ZINC000006118702	c2ccc1nccnc1c2
Cc2[nH]c1ccccc1c2CCNC(=O)Cn3cnc(N(=O)=O)n3	ZINC000000032848	O=C(Cn1cncn1)NCCc2c[nH]c3ccccc23
OCCN1CCN(CCO)CCN(CCO)CCN(CCO)CC1	ZINC000033791614	C1CNCCNCCNCCN1
CCN(CC)S(=O)(=O)c1ccc(C)cc1	ZINC000000028303	c1ccccc1
Cc1nnc(=O)[nH]c1Nc3c(C)n(C)n(c2ccccc2)c3=O	ZINC000000114457	O=c3nncc(Nc2c[nH]n(c1ccccc1)c2=O)[nH]3
Cc2ccc(S(=O)(=O)NCc1ccccc1)cc2	ZINC000000028306	O=S(=O)(NCc1ccccc1)c2ccccc2
CC(C)(c1ccccc1)c3ccc(OCC(=O)Nc2ccccc2)cc3	ZINC000000047445	O=C(COc2ccc(Cc1ccccc1)cc2)Nc3ccccc3
CCOC(=O)c1c(C)csc1NC(=O)c2ccc(C(C)(C)C)cc2	ZINC000000080445	O=C(Nc1cccs1)c2ccccc2
NC(=O)CNC(=O)OCc1ccccc1	ZINC000000024096	c1ccccc1
O=C(Cn2c(=O)c1cccc(N(=O)=O)c1c2=O)Nn3cnnc3	ZINC000000378025	O=C(Cn2c(=O)c1ccccc1c2=O)Nn3cnnc3
N=C3Nc1ccccc1[C@H]2CCCCC[C@H]23	ZINC000000024093	N=C3Nc1ccccc1C2CCCCCC23
O=C1NCCN1N=Cc2ccc(N(=O)=O)o2	ZINC000000001803	O=C1NCCN1N=Cc2ccco2
Cc3c(S(=O)(=O)c1ccc(Cl)cc1)cnc4cc(C2CC2)nn34	ZINC000000096244	O=S(=O)(c1ccccc1)c4cnc3cc(C2CC2)nn3c4
CN(C)C(=O)Cn2c(c1ccc(C(F)(F)F)cc1)nc3cccnc23	ZINC000000002336	c3ccc(c2nc1cccnc1[nH]2)cc3
CNCCCNCc2ccc(c1ccc(C(=O)OC)cc1)o2	ZINC000008377146	c2ccc(c1ccco1)cc2
COc4ccc(C[N@@]3CCc2nnc([C@@H](C)NC(=O)C1CCN(C)CC1)n2CC3)cc4C	ZINC000012204418	O=C(NCc3nnc2CCN(Cc1ccccc1)CCn23)C4CCNCC4
O=c3n1CCCSc1nc4oc2ccccc2c(=O)c34	ZINC000000025784	O=c3n1CCCSc1nc4oc2ccccc2c(=O)c34
COC(=O)c/1c(C)[nH]c(=O)c\1=C/c3cccc(OCc2ccccc2)c3	ZINC000000312502	O=c1[nH]ccc1=Cc3cccc(OCc2ccccc2)c3
C(Sc2nc1ccccc1[nH]2)c4ccc3nonc3c4	ZINC000000034405	C(Sc2nc1ccccc1[nH]2)c4ccc3nonc3c4
O=C(CSc2nc1ccccc1o2)NC3=NC(=O)CS3	ZINC000000034241	O=C(CSc2nc1ccccc1o2)NC3=NC(=O)CS3
O=C(CC[C@@H]2CCC[N@@](CCCn1cccn1)C2)N4CCN(Cc3ccccc3)CC4	ZINC000012386037	O=C(CCC2CCCN(CCCn1cccn1)C2)N4CCN(Cc3ccccc3)CC4
Cc2nnc(c1ccccc1)c(=O)n2/N=C/c3cccs3	ZINC000000032944	O=c2c(c1ccccc1)nncn2N=Cc3cccs3
Cc2cccn3C(c1ccco1)=NC(C(F)(F)F)(C(F)(F)F)N=c23	ZINC000000032940	C3N=C(c1ccco1)n2ccccc2=N3
O=N(=O)c1ccccc1S(=O)(=O)n2cccc2C=C(C#N)C#N	ZINC000000110350	O=S(=O)(c1ccccc1)n2cccc2
COC(=O)c2ccc(OC)c(S(=O)(=O)N1CCOCC1)c2	ZINC000000103476	O=S(=O)(N1CCOCC1)c2ccccc2
C[C@@H]3CN(c2oc(c1ccc(F)cc1)nc2C#N)C[C@@H](C)O3	ZINC000000038098	C3CN(c2cnc(c1ccccc1)o2)CCO3
Cc3ccc(Cn2cnc1sc(C)c(C)c1c2=O)cc3	ZINC000000038096	O=c2n(Cc1ccccc1)cnc3sccc23
CCOc2ccc(\C=N\n1c(SC)nnc(C(C)(C)C)c1=O)cc2	ZINC000000238547	O=c1cnncn1N=Cc2ccccc2
COc4ccc(c3noc([C@H]1CCCN1C(=O)c2ccccc2)n3)cc4	ZINC000000325192	O=C(N1CCCC1c3nc(c2ccccc2)no3)c4ccccc4
Fc3ccc(NC(=O)CC(c1ccccc1)c2ccccc2)c(F)c3	ZINC000000060800	O=C(CC(c1ccccc1)c2ccccc2)Nc3ccccc3
O=S(=O)(CS(=O)(=O)[n+]1ccccc1)[n+]2ccccc2	ZINC000001703751	O=S(=O)(CS(=O)(=O)[n+]1ccccc1)[n+]2ccccc2
COc3cc2nc1cc(N(=O)=O)ccc1c(NCCCNCCO)c2cc3OC	ZINC000004748028	c3ccc2nc1ccccc1cc2c3
COc1ccccc1\C=N\NC(=O)COc2ccccc2C#N	ZINC000000049919	O=C(COc1ccccc1)NN=Cc2ccccc2
Cc3cc(C)cc(OCC(=O)NCCc2nc1ccccc1[nH]2)c3	ZINC000000032015	O=C(COc1ccccc1)NCCc3nc2ccccc2[nH]3
COc2ccc(S(=O)(=O)n1ccnc1C)cc2OC	ZINC000000049263	O=S(=O)(c1ccccc1)n2ccnc2
COc3ccc(C(=O)Nc2ccc(N1CCOCC1)cc2)cc3OC	ZINC000000032017	O=C(Nc2ccc(N1CCOCC1)cc2)c3ccccc3
Oc1ccccc1[C@@H](CC(=O)N2CCOCC2)c3ccccc3	ZINC000000038360	O=C(CC(c1ccccc1)c2ccccc2)N3CCOCC3
NC(=N)c3ccc(NC(=O)[C@@H]2CC(c1cccc(C(N)=N)c1)=NO2)cc3	ZINC000013910967	O=C(Nc1ccccc1)C3CC(c2ccccc2)=NO3
CCn4c(C1CCNCC1)nn(CCN3CCN(c2ccccc2)CC3)c4=O	ZINC000065530693	O=c2[nH]c(C1CCNCC1)nn2CCN4CCN(c3ccccc3)CC4
CCOC(=O)CSc1nnnn1c2ccccc2F	ZINC000000038364	c2ccc(n1cnnn1)cc2
CCOC(=O)c1cncn1[C@H](C)c2ccccc2	ZINC000000001408	C(c1ccccc1)n2ccnc2
CC[C@@H](Cc1ccccc1)NS(=O)(=O)c2cccc3nsnc23	ZINC000000212977	O=S(=O)(NCCc1ccccc1)c2cccc3nsnc23
Cn4c(=O)n(C)c3cn(c1ccc(O)cc1)c(c2ccccc2)c3c4=O	ZINC000000205297	O=c4[nH]c(=O)c3c(c1ccccc1)n(c2ccccc2)cc3[nH]4
CCc3ccc(C(=O)Nc1cccnc1Oc2ccc(OC)cc2)cc3	ZINC000000083930	O=C(Nc1cccnc1Oc2ccccc2)c3ccccc3
COc1ccccc1N4CCN(\N=c2\c(=O)[nH]c3ccccc23)CC4	ZINC000000046712	O=c2[nH]c1ccccc1c2=NN4CCN(c3ccccc3)CC4
Cc2cnc1ccc(Br)c[n+]1c2C	ZINC000000078045	c2cc[n+]1cccnc1c2
O=C4CN(CC(=O)N3CCC[C@@H](CCC(=O)N2CCN(Cc1ccccc1)CC2)C3)N=[O+]4	ZINC000020541914	O=C4CN(CC(=O)N3CCCC(CCC(=O)N2CCN(Cc1ccccc1)CC2)C3)N=[O+]4
CC(C)=CCn1cnc(N)c2ncnc12	ZINC000000002209	c2nc1cnc[nH]c1n2
CN4CCC(CN3CCN(C(=O)c2ccc(n1cnnc1)nc2)CC3)CC4	ZINC000097696412	O=C(N2CCN(CC1CCNCC1)CC2)c4ccc(n3cnnc3)nc4
CCOC(=O)c2nnn3c1ccccc1c(SCC(N)=O)nc23	ZINC000000159538	c1ccc3c(c1)cnc2cnnn23
Clc2cc(Cl)c(NC(=O)\C=C\c1ccccc1)cc2Cl	ZINC000000046479	O=C(Nc1ccccc1)C=Cc2ccccc2
Fc3ccc(N2CCN(C(=O)\C=C\c1ccc(Cl)cc1)CC2)cc3	ZINC000000031616	O=C(C=Cc1ccccc1)N3CCN(c2ccccc2)CC3
C[N+]3(CC[N+]2(C)C[C@@H]1CCCC[C@H]1C2)CCCCC3	ZINC000001688959	C3CCN(CCN2CC1CCCCC1C2)CC3
Cc4ccc(c2nnc3s\c(=C/c1ccc(C)o1)c(=O)n23)cc4	ZINC000000032121	O=c3c(=Cc1ccco1)sc4nnc(c2ccccc2)n34
CCN(CC)S(=O)(=O)c2cccc(C(=O)NCc1ccccc1)c2	ZINC000000192897	O=C(NCc1ccccc1)c2ccccc2
Cc3cccc(COn2cccc(C(=O)Nc1ccccc1C)c2=O)c3	ZINC000000254098	O=C(Nc1ccccc1)c3cccn(OCc2ccccc2)c3=O
O=N(=O)c4ccc(c2nnc(c1ccccc1)n2c3ccccc3)cc4	ZINC000000258509	c4ccc(c2nnc(c1ccccc1)n2c3ccccc3)cc4
COC(=O)[C@@H](C)Sc2nnc(c1ccncc1)o2	ZINC000000033546	c2cc(c1nnco1)ccn2
O=C(N1CCOCC1)c3ccc(SCc2ccoc2)c(N(=O)=O)c3	ZINC000000033548	O=C(N1CCOCC1)c3ccc(SCc2ccoc2)cc3
O=C4CN3[C@H]5CC(OC(=O)c1c[nH]c2ccccc12)C[C@@H]3CC4C5	ZINC000000002688	O=C4CN3C5CC(OC(=O)c1c[nH]c2ccccc12)CC3CC4C5
OC1C[C@H]2CC3C[C@H](C1)N2CC3=O	ZINC000000002689	O=C2CN1C3CCCC1CC2C3
COC(=O)c2ccc(N(=O)=O)c(OC(=O)c1cccs1)c2	ZINC000000040885	O=C(Oc1ccccc1)c2cccs2
COC(=O)c2cnn3c(C)c(Oc1ccccc1)c(=O)[nH]c23	ZINC000000053796	O=c2[nH]c1ccnn1cc2Oc3ccccc3
CCC(C)(S(=O)(=O)CC)S(=O)(=O)CC	ZINC000000002115	nonring
CCOC(=O)c2c(C)nn(c1cccc(N(=O)=O)c1)c2C	ZINC000000027048	c2ccc(n1cccn1)cc2
COc1ccccc1C[N@]2CC[C@@H](NCCCN(C)C)[C@H](O)C2	ZINC000012146523	C2CCN(Cc1ccccc1)CC2
Cc2ccc(C)c(N(CC(=O)NCc1ccncc1)S(C)(=O)=O)c2	ZINC000000307085	O=C(CNc1ccccc1)NCc2ccncc2
FC(F)(F)c1ccccc1NC(=O)Nc2ccc(Cl)cc2Cl	ZINC000000182099	O=C(Nc1ccccc1)Nc2ccccc2
CC(C)c1nccn1CCC(=O)N4CCC(c3ncc2CNCCc2n3)CC4	ZINC000019454453	O=C(CCn1ccnc1)N4CCC(c3ncc2CNCCc2n3)CC4
Cc4nc3ccc(c2ccc1nc(C)n(N)c(=O)c1c2)cc3c(=O)n4N	ZINC000000033618	O=c3[nH]cnc4ccc(c2ccc1nc[nH]c(=O)c1c2)cc34
Fc3ccc(CNC(=O)CN1C(=O)COc2ccc(Cl)cc12)cc3	ZINC000000218512	O=C(CN1C(=O)COc2ccccc12)NCc3ccccc3
C[N+](C)(CCCCCC[N+](C)(C)CC(=O)NC(N)=O)CC(=O)NC(N)=O	ZINC000004683558	nonring
Clc2cccc3CC[C@@]1(CN=CN1)Cc23	ZINC000000019519	C2CC1(CN=CN1)Cc3ccccc23
O=C(CSc2nc(c1cccnc1)ccc2C#N)c3ccccc3	ZINC000000047870	O=C(CSc2cccc(c1cccnc1)n2)c3ccccc3
C[C@H]3CN(C(=O)c1ccc(Cl)c(Cl)c1)N=C(c2ccccc2)C3	ZINC000000018028	O=C(N2CCCC(c1ccccc1)=N2)c3ccccc3
Fc3ccc(NC(=O)c1cccc2c(Br)cccc12)cc3	ZINC000000284016	O=C(Nc1ccccc1)c2cccc3ccccc23
CCN(CC)c2nc(NCCN)c(C#N)c1CC[N@](CC)Cc12	ZINC000013764334	C2Cc1ccncc1CN2
CC(=O)c2cc1OCOc1cc2NC(=O)c3c(Cl)cnn3C	ZINC000000046872	O=C(Nc2ccc1OCOc1c2)c3ccn[nH]3
CCOc1cc(CNCCCN(C)C)cc(Br)c1OCC(N)=O	ZINC000008253718	c1ccccc1
COc3ccc([C@H]1OC[C@]2(COC(C)=O)[C@@H](C)C=C(C)[C@H]1[C@H]2C)cc3	ZINC000000121070	C2OC(c1ccccc1)C3CC2CC=C3
O=C(OOC(=O)c1ccccc1)c2ccccc2	ZINC000000001016	O=C(OOC(=O)c1ccccc1)c2ccccc2
Nc3ncnc4n(C1CCN(CCO)CC1)cc(c2cccc(O)c2)c34	ZINC000001493882	C4CC(n2cc(c1ccccc1)c3cncnc23)CCN4
CCCn2c(=O)c1ccccc1oc3ccccc23	ZINC000000014020	O=c2[nH]c1ccccc1oc3ccccc23
Nc2nc(N)nc(c1cnccn1)n2	ZINC000000023810	c2cnc(c1ncncn1)cn2
CC3(C)O[C@H]2O[C@@H](CNC(=N)NC(N)=N)[C@H]1OC(C)(C)O[C@H]1[C@H]2O3	ZINC000026190156	C3OC2COC1OCOC1C2O3
CCN(CC)c2ccc(NC(=O)c1ccccc1Br)cc2	ZINC000000129271	O=C(Nc1ccccc1)c2ccccc2
CC(C)(C)n2c[n+](c1ccccc1)nn2	ZINC000000071140	c2ccc([n+]1c[nH]nn1)cc2
CN(C)CCNc2ncnc3n(c1ccncc1)c(C)c(C)c23	ZINC000005322583	c3cc(n1ccc2cncnc12)ccn3
C[N+]2(C)CCc1cc(Br)ccc12	ZINC000000021672	C2Cc1ccccc1N2
Clc2ccc(Cl)c(S(=O)(=O)Nc1cccnc1)c2	ZINC000000029680	O=S(=O)(Nc1cccnc1)c2ccccc2
COCCN3CCC(C[N@@](C[C@@H]1CCCO1)Cc2cccnc2)CC3	ZINC000011821532	C3COC(CN(CC1CCNCC1)Cc2cccnc2)C3
CCN3CCN(C2CCN(Cc1ccc(OC)cc1)CC2)CC3	ZINC000019888823	C3CN(C2CCN(Cc1ccccc1)CC2)CCN3
COc3ccc(CC2CCC(=NOC(=O)C1CCCCC1)CC2)cc3	ZINC000000135465	O=C(ON=C2CCC(Cc1ccccc1)CC2)C3CCCCC3
CNC(=N)SCCCCCCSC(=N)NC	ZINC000001666239	nonring
CC(=O)Nc2cccc(c1cn[nH]n1)c2	ZINC000000027314	c2ccc(c1cn[nH]n1)cc2
Nc1nnnn1/N=C/c2cccc(I)c2	ZINC000000055417	C(=Nn1cnnn1)c2ccccc2
CC(C)c2[nH]c1ccccc1c2C(=O)c3cccnc3	ZINC000000001801	O=C(c1cccnc1)c2c[nH]c3ccccc23
O[C@@H](c2ccc(c1ccccc1)cc2)c4cc3cc(N(=O)=O)ccc3o4	ZINC000000083750	C(c2ccc(c1ccccc1)cc2)c4cc3ccccc3o4
Nc2c1CCCCc1nc3cccc(F)c23	ZINC000000010131	C3CCc2nc1ccccc1cc2C3
CCN3CCN(Cc1ccc(OC)cc1OC[C@H](O)CN2CCCC2)CC3	ZINC000019838701	C3CCN(CCCOc1ccccc1CN2CCNCC2)C3
O=C1CCC(=O)N1CC(=O)n3c2ccccc2sc4ccccc34	ZINC000000063746	O=C1CCC(=O)N1CC(=O)n3c2ccccc2sc4ccccc34
CC(C)NCC(=O)Nc2ccc(S(=O)(=O)c1ccc(NC(=O)CNC(C)C)cc1)cc2	ZINC000001580998	O=S(=O)(c1ccccc1)c2ccccc2
O=c2n(N1CCOCC1)nnc3ccccc23	ZINC000000001746	O=c2n(N1CCOCC1)nnc3ccccc23
Clc2ccc(C(=O)C[C@H](C(C#N)C#N)c1ccccc1Cl)cc2	ZINC000000279040	O=C(CCc1ccccc1)c2ccccc2
Fc3cccc(CNC(=O)c2c[nH]c1ccccc1c2=O)c3	ZINC000000026375	O=C(NCc1ccccc1)c3c[nH]c2ccccc2c3=O
CCOc3ccc2ncc(C(=O)NCc1cccnc1)c(O)c2c3	ZINC000000026377	O=C(NCc1cccnc1)c3cnc2ccccc2c3
Cc4ccc(C3=NN[C@@H](c2cc1OCOc1cc2N(=O)=O)S3)cc4	ZINC000000048428	C4Oc3ccc(C2NN=C(c1ccccc1)S2)cc3O4
COc3ccc(Cn2c(=O)c1ccccc1c2=O)cc3OC	ZINC000000021413	O=c2n(Cc1ccccc1)c(=O)c3ccccc23
CN(C)CCCN(CCCN(C)C)c1ccc(N(=O)=O)cc1N(=O)=O	ZINC000004859554	c1ccccc1
Clc3c(c2nnc(c1cccs1)o2)sc4ccccc34	ZINC000000036713	c4ccc3sc(c2nnc(c1cccs1)o2)cc3c4
Clc3cccc(NC(=O)c2ccc(Oc1ccc(C#N)cc1)cc2)c3	ZINC000000353734	O=C(Nc1ccccc1)c3ccc(Oc2ccccc2)cc3
Cc4ccc(C2(c1ccc(C)cc1)C[C@@H]2C(=O)Nc3cccnc3)cc4	ZINC000000233545	O=C(Nc1cccnc1)C2CC2(c3ccccc3)c4ccccc4
CN(C)C2=NC(=O)[C@H](c1ccccc1)O2	ZINC000000000764	O=C1N=COC1c2ccccc2
COc2cc([C@@H]1NC(=O)CC[C@@H]1N(=O)=O)cc(OC)c2OC	ZINC000000036484	O=C2CCCC(c1ccccc1)N2
COC(=O)c2cc(C(=O)N1C[C@@H](C)O[C@H](C)C1)cc(N(=O)=O)c2	ZINC000000029067	O=C(N1CCOCC1)c2ccccc2
NS(=O)(=O)c2ccc(NC(=O)c1cccc(F)c1)cc2	ZINC000000035620	O=C(Nc1ccccc1)c2ccccc2
c3csc(c2cc1nccn1[nH]2)c3	ZINC000000004424	c3csc(c2cc1nccn1[nH]2)c3
COc3cc(Cl)cc(\C=c2\sc(c1ccccc1)nc2=O)c3O	ZINC000000115738	O=c2nc(c1ccccc1)sc2=Cc3ccccc3
COC(=O)c3ccc2CN(c1ccc(Br)cc1)Cc2c3	ZINC000000036933	C2N(c1ccccc1)Cc3ccccc23
NC(=N)Nc2ccc(OC(=O)c1ccc(NC(N)=N)cc1)cc2	ZINC000006535424	O=C(Oc1ccccc1)c2ccccc2
Cn3c(CCCCc2n(C)c1ccccc1[n+]2C)[n+](C)c4ccccc34	ZINC000001833372	C(CCc2nc1ccccc1[nH]2)Cc4nc3ccccc3[nH]4
C[N@]2Cc1ccccc1C[C@@H]2CNC(=O)c4cn(CCN3CCNCC3)nn4	ZINC000077556078	O=C(NCC2Cc1ccccc1CN2)c4cn(CCN3CCNCC3)nn4
COc1ccc(Cl)cc1c3nc(c2nonc2N)no3	ZINC000000053804	c3ccc(c2nc(c1cnon1)no2)cc3
C[C@H](Cn1nc(C)cc1C)N3CCC(n2cc(C(C)(C)N)nn2)CC3	ZINC000020820380	C2CN(CCn1cccn1)CCC2n3ccnn3
Cc2ccc(NC(=O)COc1ccc(N(=O)=O)cc1)cc2C	ZINC000000038368	O=C(COc1ccccc1)Nc2ccccc2
C[N@]1CCN3[C@@H](C1)c2ccccc2Cc4ccccc34	ZINC000000000504	C1CN3C(CN1)c2ccccc2Cc4ccccc34
COc2ccc([C@@H]1NC(=O)[C@H](C)S1)cc2OC	ZINC000000000503	O=C2CSC(c1ccccc1)N2
C4CN(c3cccc(c1ccccc1CN2CCOCC2)n3)CCN4	ZINC000020587330	C4CN(c3cccc(c1ccccc1CN2CCOCC2)n3)CCN4
COc3ccc(\C=c2/c(c1ccccc1)noc2=O)cc3	ZINC000000043610	O=c2onc(c1ccccc1)c2=Cc3ccccc3
COC(=O)CNS(=O)(=O)c1c(C)cc(C)cc1C	ZINC000000029668	c1ccccc1
CCCc2cc(=O)oc3cc(OCc1ccccc1Cl)ccc23	ZINC000000044646	O=c3ccc2ccc(OCc1ccccc1)cc2o3
CC(C)Nc2nc(Cl)nc(N1CCCCC1)n2	ZINC000000059237	C2CCN(c1ncncn1)CC2
Nc1nonc1n2nnc(C(O)=O)c2CN3CCCCCC3	ZINC000000093977	C3CCCN(Cc1cnnn1c2cnon2)CC3
Cc2nc1ccccc1c(=O)n2C[C@H](O)CO	ZINC000000000234	O=c1[nH]cnc2ccccc12
NC(=O)C4(N1CCCCC1)CCN(Cc3cc2CNCCCn2n3)CC4	ZINC000072169702	C4CCN(C3CCN(Cc2cc1CNCCCn1n2)CC3)CC4
CC(C)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000000030397	c1ccccc1
Cc1cc(C)c(OC[C@H](O)CO)c(C)c1	ZINC000000000437	c1ccccc1
COc3cc2CC(C)=NN=C(c1cccc(Cl)c1)c2cc3OC	ZINC000000000340	C2C=NN=C(c1ccccc1)c3ccccc23
Cn2c(NCc1ccccn1)nc3n(C)c(=O)n(C)c(=O)c23	ZINC000000159290	O=c3[nH]c(=O)c2[nH]c(NCc1ccccn1)nc2[nH]3
CS(=O)(=O)c2c(F)cc(c1cc(C(N)=O)c(Cl)nn1)cc2F	ZINC000000006919	c2ccc(c1cccnn1)cc2
O=C(Nc2cccc(CC(=S)N1CCOCC1)c2)c3ccccc3	ZINC000000081271	O=C(Nc2cccc(CC(=S)N1CCOCC1)c2)c3ccccc3
Cn2cc(NC(=O)[C@@H]1CCC(N)=N1)cc2C(=O)NCCC(N)=N	ZINC000001617766	O=C(Nc1cc[nH]c1)C2CCC=N2
CC(C)NC(=O)CC(c1ccccc1)c2ccccc2	ZINC000000030150	C(c1ccccc1)c2ccccc2
COc3cccc(NC(=O)[C@H]2CN(c1ccccc1)C(=O)C2)c3	ZINC000000044396	O=C2CC(C(=O)Nc1ccccc1)CN2c3ccccc3
COC(=O)c2cn(C(=O)c1nn(C)cc1N(=O)=O)c3ccccc23	ZINC000000078826	O=C(c1cc[nH]n1)n2ccc3ccccc23
Cc2ccc(NCC(=O)Nc1ccc(Cl)c(Cl)c1)cc2C	ZINC000000042705	O=C(CNc1ccccc1)Nc2ccccc2
Cn4c2ccc(C1=NCCN1)cc2c5cc(C3=NCCN3)ccc45	ZINC000001660295	C5CN=C(c4ccc3[nH]c2ccc(C1=NCCN1)cc2c3c4)N5
CCOc3nc(N1CCCCC1)nc(N2CCOCC2)n3	ZINC000000096090	C3CCN(c2ncnc(N1CCOCC1)n2)CC3
Cc2c(NC(=O)c1ccc(Br)o1)cccc2N(=O)=O	ZINC000000038394	O=C(Nc1ccccc1)c2ccco2
CN4CCN(\C=N\c3nc1CCCCc1c(c2ccccc2)c3C#N)CC4	ZINC000002585234	C1CCc3c(C1)nc(N=CN2CCNCC2)cc3c4ccccc4
C[N+]2(C)CCN([N+](\O)=N\Oc1ccc(N(=O)=O)cc1N(=O)=O)CC2	ZINC000043071834	C2CN(N=NOc1ccccc1)CCN2
Cc2cc1C[N+](=O)C(C)(C)CCc1c(C)c2O	ZINC000000006772	O=[N+]2CCCc1ccccc1C2
COCCN3CCC(C[N@@](C[C@@H]1CCCO1)C2CCN(C(C)=O)CC2)CC3	ZINC000012314980	C3COC(CN(CC1CCNCC1)C2CCNCC2)C3
CN(C)CCN(C)[C@@H]1[C@H](O)[C@H](CO)O[C@@H]1CNC2CCN(C)CC2	ZINC000020464983	C2COC(CNC1CCNCC1)C2
Cc3ncc(CN2CCC(Cn1cc(CN)nn1)CC2)s3	ZINC000023159197	C2CN(Cc1cncs1)CCC2Cn3ccnn3
CCOc1cc(C)nn1c2ccc(N(=O)=O)cc2	ZINC000000031376	c2ccc(n1cccn1)cc2
Cc4ccc(C(=O)Nc3cc2c(ccc1ccccc12)oc3=O)cc4C	ZINC000000381311	O=C(Nc3cc2c(ccc1ccccc12)oc3=O)c4ccccc4
CNc3nc(C1CCNCC1)nc2CN(C(=O)CN(C)C)CCc23	ZINC000019711356	C3CC(c2ncc1CCNCc1n2)CCN3
COc3ccc(OC)c(NC(=O)c2ccc(Oc1ccccc1)cc2)c3	ZINC000000364200	O=C(Nc1ccccc1)c3ccc(Oc2ccccc2)cc3
CC(=C)c2cccc(C(C)(C)NC(=O)NCc1ccc(Cl)cc1)c2	ZINC000000205627	O=C(NCc1ccccc1)NCc2ccccc2
CC(C)c2ncc(S(=O)(=O)c1ccc(C(F)(F)F)cn1)c(N)n2	ZINC000000149255	O=S(=O)(c1cncnc1)c2ccccn2
Fc4ccc(N3C(=O)C[C@H](NCC2CCN(Cc1cccs1)CC2)C3=O)cc4	ZINC000004784435	O=C3CC(NCC2CCN(Cc1cccs1)CC2)C(=O)N3c4ccccc4
CC(=O)Nc2ccc(NC(=O)c1ccc(C)c(Br)c1)cc2	ZINC000000038550	O=C(Nc1ccccc1)c2ccccc2
CN(C)CCn3cc(NC(=O)CCN2CCN(c1ccccn1)CC2)cn3	ZINC000078030957	O=C(CCN2CCN(c1ccccn1)CC2)Nc3cn[nH]c3
CN(CC(=O)NC(=O)NCC=C)CC(=O)N1CCNCC1	ZINC000038031330	C1CNCCN1
CN(C)C(=O)CSc2nc1ccccc1c(=O)n2c3ccccc3	ZINC000000045758	O=c2n(c1ccccc1)cnc3ccccc23
CSc1cc(C(C)(C)C)nn1S(=O)(=O)c2ccc(F)cc2F	ZINC000000142267	O=S(=O)(c1ccccc1)n2cccn2
COCCOc3ccc(C(=O)N[C@@H]2CN(C1CCN(C)CC1)CCC[C@H]2O)cc3	ZINC000015672213	O=C(NC2CCCCN(C1CCNCC1)C2)c3ccccc3
CSc1sc(SC)c(Br)c1Br	ZINC000000042383	c1ccsc1
Cc4cc(C)c3c(n1cccc1)c(C(=O)Oc2ccccc2)sc3n4	ZINC000000095093	O=C(Oc1ccccc1)c3sc2ncccc2c3n4cccc4
COc3cccc(C[N@]2CCN(C1CCN(C(C)C)CC1)[C@@H](CCO)C2)c3O	ZINC000019336397	C3CC(N2CCN(Cc1ccccc1)CC2)CCN3
Cn3c(=O)n(C)c4cc(CNCc1ccccc1OC[C@@H](O)CN2CCCCC2)ccc34	ZINC000014952646	O=c4[nH]c3ccc(CNCc1ccccc1OCCCN2CCCCC2)cc3[nH]4
COc2cccc3[C@H](c1c[nH]cn1)CCCc23	ZINC000000021287	C3CC(c1c[nH]cn1)c2ccccc2C3
C4CCN(CCCNCc2cc(c1ccccc1)cn3nnnc23)CC4	ZINC000012224355	C4CCN(CCCNCc2cc(c1ccccc1)cn3nnnc23)CC4
CN4CCN(c3ncc(CNCCc2nnc1CCCCCn12)cn3)CC4	ZINC000079064247	C4CCc3nnc(CCNCc2cnc(N1CCNCC1)nc2)n3CC4
CCOc2ccc(S(=O)(=O)N1CCC(C)CC1)c3ccccc23	ZINC000000032958	O=S(=O)(N1CCCCC1)c2cccc3ccccc23